Component ID |
TCMH1122 |
Latin Name |
Psammosilene tunicoides |
English Name |
Tuniclike psammosilene |
Chinese Pinyin Name |
Jin Tie Suo |
中文名 |
金铁锁 |
TCM Properties |
|
TCM Meridians |
|
Therapeutic Class English |
|
Therapeutic Class Chinese |
|
Functions |
|
Toxicity |
NA |
Geo-authentic habitats (道地产区) |
NA |
Reference |
CFDA |
Barcode ID |
ITSAQ267-14 |
Barcode Source |
BOLDSYSTEMS |
Prescription ID | Prescription English Name | Prescription Chinese Name |
---|---|---|
TCMFx3105 | Bai Bao Dan | 百宝丹 |
TCMF3807 | Du Zhong Zhuang Gu Capsules | 杜仲壮骨胶囊 |
TCMF3815 | Du Zhong Zhuang Gu Pills | 杜仲壮骨丸 |
TCMFx7194 | Hong Yao Capsules | 红药胶囊 |
TCMFx7153 | Jin Gu Lian Tablets | 金骨莲片 |
TCMFx6436 | Xue Shang Yi Zhi Hao Su Xiao Zhi Tong Cha Ji | 雪上一枝蒿速效止痛搽剂 |
TCMFx6312 | Yi Li Zhi Tong Pills | 一粒止痛丸 |
TCMFx6665 | Yun Nan Hong Yao Capsules | 云南红药胶囊 |
TCMFx6671 | Yun Nan Hong Yao Powder | 云南红药散 |
Target ID | Gene Symbol | Target Name | Target Class | Uniprot ID |
---|---|---|---|---|
TCMT133 | CA1 | Carbonic anhydrase I | Lyase | P00915 |
TCMT134 | CA2 | Carbonic anhydrase II | Lyase | P00918 |
TCMT135 | CA14 | Carbonic anhydrase XIV | Lyase | Q9ULX7 |
TCMT136 | CA12 | Carbonic anhydrase XII | Lyase | O43570 |
TCMT137 | CA9 | Carbonic anhydrase IX | Lyase | Q16790 |
TCMT138 | CA7 | Carbonic anhydrase VII | Lyase | P43166 |
TCMT162 | UGT1A1 | UDP-glucuronosyltransferase 1-1 | Transferase | P22309 |
TCMT281 | DPP4 | Dipeptidyl peptidase IV | Unclassified | P27487 |
TCMT33 | CYP3A4 | Cytochrome P450 3A4 | Oxidoreductase | P08684 |
TCMT34 | CYP2D6 | Cytochrome P450 2D6 | Oxidoreductase | P10635 |
TCMT41 | IDH1 | Isocitrate dehydrogenase [NADP] cytoplasmic | Oxidoreductase | O75874 |
TCMT614 | EGLN1 | Egl nine homolog 1 | Oxidoreductase | Q9GZT9 |
Target ID | Target Name |
---|---|
TCMT1104 | Sortase |
TCMT1170 | Enterobacter cloacae |
TCMT1218 | Staphylococcus aureus |
TCMT1229 | Enterococcus faecalis |
TCMT1232 | Pseudomonas aeruginosa |
TCMT1246 | Escherichia coli |
TCMT1251 | Candida albicans |
TCMT1438 | Plasmodium falciparum |
TCMT1454 | Bacillus subtilis |
TCMT1465 | Entamoeba histolytica |
Ingredient ID: TCMC995
Formula: C35H60O6
Common Name | Daucosterol |
IUPAC Name | (2R,3R,4S,5S,6R)-2-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol |
Canonical SMILES | CC[C@@H](C(C)C)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H](C2)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)C |
Standard InCHI | InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1 |
Standard InCHIKey | NPJICTMALKLTFW-OFUAXYCQSA-N |
External Identifiers | ChEMBL [CHEMBL506678]; PubChem [5742590]; |
Reference of Component-Ingredient Pair | 16261518 |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH86 | Ampelopsis japonica | Bai Lian | 白蔹 |
TCMH1862 | Cornus officinalis | Shan Zhu Yu | 山茱萸 |
TCMH600 | Euonymus fortunei | Fu Fang Teng | 扶芳藤 |
TCMH1673 | Gentiana macrophylla | Qin Jiao | 秦艽 |
TCMH2595 | Rhododendron micranthum | Zhao Shan Bai | 照山白 |
TCMH1739 | Ficus microcarpa | Rong Shu Ye | 榕树叶 |
TCMH945 | Sophora japonica | Huai Zhi | 槐枝 |
TCMH284 | Melia toosendan | Chuan Lian Zi | 川楝子 |
TCMH1656 | Angelica decursiva | Qian Hu | 前胡 |
TCMH695 | Uncaria rhynchophylla | Gou Teng | 钩藤 |
TCMH1865 | Paeonia obovata | Shao Yao | 芍药 |
TCMH1264 | Litchi chinensis | Li Zhi He | 荔枝核 |
TCMH1011 | Sargentodoxa cuneata | Huo Xue Teng | 活血藤 |
TCMH2166 | Clematis chinensis | Wei Ling Xian | 威灵仙 |
TCMH1144 | Schizonepetae herba | Jing Jie Tan | 荆芥炭 |
TCMH63 | Lilium brownii | Bai He Liu Jin Gao | 百合流浸膏 |
TCMH803 | Massa hanshi fermentata | Han Shi | 寒食 |
TCMH271 | Clerodendrum trichotomum | Chou Wu Tong Ye | 臭梧桐叶 |
TCMH1348 | Liquidambar formosana | Lu Lu Tong | 路路通 |
TCMH123 | Pteris semipinnata | Ban Bian Qi | 半边旗 |
TCMH2513 | Rhododendron mucronulatum | Ying Shan Hong | 映山红 |
TCMH2134 | Smilax glabra | Tu Fu Ling | 土茯苓 |
TCMH1830 | Anisodus tanguticus | Shan Lang Dang | 山莨菪 |
TCMH865 | Carthamus tinctorius | Hong Hua | 红花 |
TCMH1186 | Lycium chinense | Gou Qi Zi | 枸杞子 |
TCMH845 | Auricularia auricula-judae | Hei Mu Er | 黑木耳 |
TCMH1740 | Cistanche deserticola | Rou Cong Rong | 肉苁蓉 |
TCMH1796 | Morus alba | Sang Shen Qing Gao | 桑葚清膏 |
TCMH844 | Breynia fruticosa | Hei Mian Shen | 黑面神 |
TCMH2185 | Acanthopanax gracilistylus | Wu Jia Pi | 五加皮 |
TCMH1674 | Gentiana straminea | Qin Jiao Hua | 秦艽花 |
TCMH274 | Fritillaria cirrhosa | Chuan Bei Mu Liu Jin Gao | 川贝母流浸膏 |
TCMH1562 | Arctium lappa | Niu Bang Zi | 牛蒡子 |
TCMH2244 | Prunella vulgaris | Xia Ku Cao | 夏枯草 |
TCMH1460 | Zanthoxylum nitidum | Mao Liang Mian Zhen | 毛两面针 |
TCMH316 | Ailanthi cortex | Chun Pi | 椿皮 |
TCMH2491 | Alpinia oxyphylla | Yi Zhi Ren | 益智仁 |
TCMH2137 | Pogostemon cablin | Tu Huo Xiang | 土藿香 |
TCMH985 | Astragalus membranaceus | Huang Qi Ti Qu Ye | 黄芪提取液 |
TCMH2515 | Papaver somniferum | Ying Su Ke | 罂粟壳 |
TCMH2265 | Cyperus rotundus | Xiang Fu | 香附 |
TCMH2218 | Rubia cordifolia | Qian Cao Teng | 茜草藤 |
TCMH2556 | Polygala tenuifolia | Yuan Zhi Liu Jin Gao | 远志流浸膏 |
TCMH2436 | Elaeagnus pungens | Yang Nai Nai Ye | 羊奶奶叶 |
TCMH367 | Caulis sargentodoxae | Da Huo Xue | 大活血 |
TCMH741 | Fructus choerospondiatis | Guang Zao | 广枣 |
TCMH2077 | Prunus persica | Tao Zhi | 桃枝 |
TCMH213 | Boschniakia rossica | Cao Cong Rong | 草苁蓉 |
TCMH1105 | Trollius chinensis | Jin Lian Hua | 金莲花 |
TCMH748 | Euonymus alatus | Gui Jian Yu | 鬼箭羽 |
TCMH2050 | Punica granatum | Suan Shi Liu | 酸石榴 |
TCMH207 | Fructus xanthii sibirici | Cang Er Zi Jin Gao Fen | 苍耳子浸膏粉 |
TCMH1894 | Pinellia ternata | Sheng Ban Xia | 生半夏 |
TCMH409 | Salvia miltiorrhiza | Dan Shen Jin Gao | 丹参浸膏 |
TCMH445 | Hypericum japonicum | Di Er Cao | 地耳草 |
TCMH2275 | Dracocephalum moldavica | Xiang Qing Lan | 香青兰 |
TCMH2462 | Crataegus pinnatifida | Ye Shan Zha | 野山楂 |
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
TCMH108 | Perilla frutescens | Bai Su Zi | 白苏子 |
TCMH1950 | Herba selaginellae doederleinii | Shi Shang Bai | 石上柏 |
TCMH1299 | Ganoderma lucidum | Ling Zhi(1) | 灵芝 |
TCMH1432 | Vitex trifolia | Man Jing Zi | 蔓荆子 |
TCMH1839 | Panax ginseng | Shan Shen | 山参 |
TCMH1519 | Oroxylum indicum | Mu Hu Die | 木蝴蝶 |
TCMH2286 | Berberis julianae | Xiao Bo Gen | 小檗根 |
TCMH1446 | Vaccinium oxycoccos | Man Yue Mei | 蔓越莓 |
TCMH2090 | Gastrodia elata | Tian Ma | 天麻 |
TCMH1523 | Oleum viticis negundo | Mu Jing You | 牡荆油 |
TCMH2232 | Scutellaria amoena | Xi Nan Huang Qin | 西南黄芩 |
TCMH2726 | Pterocarpus indicus | Zi Tan | 紫檀 |
TCMH1522 | Folium viticis negundo | Mu Jing Ye | 牡荆叶 |
TCMH1393 | Verbena officinalis | Ma Bian Cao | 马鞭草 |
TCMH829 | Semen pharbitidis | Hei Chou | 黑丑 |
TCMH366 | Rheum officinale | Da Huang Liu Jin Gao | 大黄流浸膏 |
TCMH1601 | Nelumbo nucifera | Ou Pian | 藕片 |
TCMH1611 | Rhizoma curcumae | Peng E Zhu | 蓬莪术 |
TCMH255 | Vigna angularis | Chi Dou | 赤豆 |
TCMH1197 | Selaginella tamariscina | Juan Bai | 卷柏 |
TCMH37 | Smilax china | Ba Qia | 菝葜 |
TCMH287 | Clematidis armandii caulis | Chuan Mu Tong | 川木通 |
TCMH1078 | Fructus gardeniae preparata | Jiao Shan Zhi | 焦山栀 |
TCMH1518 | Chaenomeles sinensis | Mu Gua | 木瓜 |
TCMH1285 | Orobanche coerulescens | Lie Dang | 列当 |
TCMH1798 | Morus alba | Sang Zhi | 桑枝 |
TCMH670 | Ligusticum sinense | Gao Ben | 藁本 |
TCMH1033 | Centella asiatica | Ji Xue Cao | 积雪草 |
TCMH1823 | Alpinia zerumbet | Shan Jiang | 山姜 |
TCMH1889 | Lycopodium japonicum | Shen Jin Cao | 伸筋草 |
TCMH2263 | Isodon amethystoides | Xiang Cha Cai | 香茶菜 |
TCMH1117 | Rhizoma fagopyri cymosi | Jin Qiao Mai | 金荞麦 |
TCMH1958 | Diospyros kaki | Shi Ye | 柿叶 |
TCMH1396 | Portulaca oleracea | Ma Chi Xian | 马齿苋 |
TCMH1371 | Arachis hypogaea | Luo Hua Sheng Zhi Ye | 落花生枝叶 |
TCMH970 | Vitex negundo | Huang Jing Zi | 黄荆子 |
TCMH2452 | Chrysanthemum indicum | Ye Ju Hua | 野菊花 |
TCMH1539 | Cucurbita moschata | Nan Gua | 南瓜 |
TCMH1038 | Spatholobus suberectus | Ji Xue Teng Gao | 鸡血藤膏 |
TCMH1766 | Sparganium stoloniferum | San Ling | 三棱 |
TCMH1032 | Impatiens balsamina | Ji Xing Zi | 急性子 |
TCMH1660 | Senecio scandens | Qian Li Guang | 千里光 |
TCMH864 | Aster ageratoides | Hong Guan Yao | 红管药 |
TCMH1121 | Cardiospermum halicacabum | Jin Si Ku Lian | 金丝苦楝 |
TCMH500 | Benincasa hispida | Dong Gua Zi | 冬瓜子 |
TCMH563 | Anisomeles indica | Fang Feng Cao | 防风草 |
TCMH2356 | Daemonorops draco | Xue Xie | 血蝎 |
TCMH1448 | Mangifera indica | Mang Guo Ye | 芒果叶 |
TCMH2117 | Lepidium apetalum | Ting Li Zi | 葶苈子 |
TCMH2371 | Juniperus formosana | Yan Bai | 岩柏 |
TCMH1176 | Allium tuberosum | Jiu Zi | 韭子 |
TCMH1588 | Achyranthes bidentata | Niu Xi | 牛膝 |
TCMH1135 | Rosa laevigata | Jin Ying Zi Ti Qu Ye | 金樱子提取液 |
TCMH2511 | Zanthoxylum avicennae | Ying Bu Bo | 鹰不泊 |
TCMH76 | Thlaspi arvense | Bai Jiang Cao | 败酱草 |
TCMH1531 | Akebia quinata | Mu Tong | 木通 |
TCMH1179 | Citri exocarpium rubrum | Ju Hong | 橘红 |
TCMH1132 | Radix rosae laevigatae | Jin Ying Gen | 金樱根 |
TCMH348 | Lobelia chinensis | Da Ban Bian Lian | 大半边莲 |
TCMH562 | Saposhnikovia divaricata | Fang Feng | 防风 |
TCMH906 | Viscum coloratum | Hu Ji Sheng | 槲寄生 |
TCMH1804 | Amomum villosum | Sha Ren Ye | 砂仁叶 |
TCMH1305 | Laggera alata | Liu Ling Ju | 六棱菊 |
TCMH1428 | Ophiopogon japonicus | Mai Men Dong | 麦门冬 |
TCMH1965 | Rheum palmatum | Shu Da Huang | 熟大黄 |
TCMH1714 | Lonicera japonica | Ren Dong Teng | 忍冬藤 |
TCMH2213 | Ipomoea cairica | Wu Zhao Long | 五爪龙 |
TCMH2092 | Asparagus cochinchinensis | Tian Men Dong | 天门冬 |
TCMH1777 | Panax notoginseng | San Qi Ye Jing | 三七叶茎 |
TCMH385 | Sargentodoxa cuneata | Da Xue Teng | 大血藤 |
TCMH1155 | Allium tuberosum | Jiu Cai | 韭菜 |
TCMH149 | Lepidium apetalum | Bei Ting Li Zi | 北葶苈子 |
TCMH2116 | Lepidium apetalum | Ting Li Cao | 葶苈草 |
TCMH590 | Impatiens balsamina | Feng Xian Hua | 凤仙花 |
TCMH591 | Impatiens balsamina | Feng Xian Tou Gu Cao | 凤仙透骨草 |
TCMH1759 | Asparagus cochinchinensis | San Bai Bang | 三百棒 |
TCMH2084 | Asparagus cochinchinensis | Tian Dong | 天冬 |
TCMH1803 | Amomum villosum | Sha Ren | 砂仁 |
TCMH737 | Crataegus pinnatifida | Guang Shan Zha | 广山楂 |
TCMH1848 | Crataegus pinnatifida | Shan Zha | 山楂 |
TCMH1849 | Crataegus pinnatifida | Shan Zha Chou Gao | 山楂稠膏 |
TCMH1852 | Crataegus pinnatifida | Shan Zha Qing Gao | 山楂清膏 |
TCMH1853 | Crataegus pinnatifida | Shan Zha Tan | 山楂炭 |
TCMH1175 | Cornus officinalis | Jiu Yu Rou | 酒萸肉 |
TCMH273 | Fritillaria cirrhosa | Chuan Bei Mu | 川贝母 |
TCMH918 | Elaeagnus pungens | Hu Tui Zi Ye | 胡颓子叶 |
TCMH122 | Lobelia chinensis | Ban Bian Lian | 半边莲 |
TCMH62 | Lilium brownii | Bai He | 百合 |
TCMH2071 | Prunus persica | Tao | 桃 |
TCMH2073 | Prunus persica | Tao Ren | 桃仁 |
TCMH2074 | Prunus persica | Tao Ren Shuang | 桃仁霜 |
TCMH1584 | Achyranthes bidentata | Niu Teng | 牛藤 |
TCMH1127 | Lonicera japonica | Jin Yin Hua | 金银花 |
TCMH1128 | Lonicera japonica | Jin Yin Hua Ti Qu Ye | 金银花提取液 |
TCMH498 | Benincasa hispida | Dong Gua Pi | 冬瓜皮 |
TCMH52 | Semen pharbitidis | Bai Chou | 白丑 |
TCMH1185 | Lycium chinense | Gou Qi | 枸杞 |
TCMH592 | Liquidambar formosana | Feng Xiang Ye | 枫香叶 |
TCMH594 | Liquidambar formosana | Feng Xiang Zhi Chou Gao | 枫香脂稠膏 |
TCMH1738 | Ficus microcarpa | Rong Shu Xu | 榕树须 |
TCMH270 | Clerodendrum trichotomum | Chou Wu Tong | 臭梧桐 |
TCMH130 | Pinellia ternata | Ban Xia | 半夏 |
TCMH131 | Pinellia ternata | Ban Xia Qu | 半夏曲 |
TCMH1677 | Pinellia ternata | Qing Ban Xia | 清半夏 |
TCMH544 | Curcuma aeruginosa | E Zhu | 莪术 |
TCMH740 | Rhizoma curcumae | Guang Xi E Zhu | 广西莪术 |
TCMH938 | Sophora japonica | Huai Hua | 槐花 |
TCMH940 | Sophora japonica | Huai Jiao | 槐角 |
TCMH941 | Sophora japonica | Huai Mi | 槐米 |
TCMH363 | Rheum officinale | Da Huang | 大黄 |
TCMH365 | Rheum officinale | Da Huang Jin Gao | 大黄浸膏 |
TCMH1943 | Punica granatum | Shi Liu | 石榴 |
TCMH1944 | Punica granatum | Shi Liu Pi | 石榴皮 |
TCMH1945 | Punica granatum | Shi Liu Zi | 石榴子 |
TCMH1431 | Vitex trifolia | Man Jing Ye | 蔓荆叶 |
TCMH258 | Paeonia obovata | Chi Shao | 赤芍 |
TCMH1770 | Panax notoginseng | San Qi Gan Jin Gao | 三七干浸膏 |
TCMH1771 | Panax notoginseng | San Qi Gao Fen | 三七膏粉 |
TCMH1772 | Panax notoginseng | San Qi Hua | 三七花 |
TCMH1774 | Panax notoginseng | San Qi Jing Ye | 三七茎叶 |
TCMH1776 | Panax notoginseng | San Qi Ye | 三七叶 |
TCMH2488 | Alpinia oxyphylla | Yi Zhi | 益智 |
TCMH206 | Fructus xanthii sibirici | Cang Er Zi | 苍耳子 |
TCMH981 | Astragalus membranaceus | Huang Qi | 黄芪 |
TCMH983 | Astragalus membranaceus | Huang Qi Gan Jin Gao | 黄芪干浸膏 |
TCMH984 | Astragalus membranaceus | Huang Qi Jin Gao | 黄芪浸膏 |
TCMH1296 | Ganoderma lucidum | Ling Zhi Jin Gao | 灵芝浸膏 |
TCMH209 | Anisodus tanguticus | Cang Qie Gen | 藏茄根 |
TCMH2554 | Polygala tenuifolia | Yuan Zhi | 远志 |
TCMH2555 | Polygala tenuifolia | Yuan Zhi Jin Gao | 远志浸膏 |
TCMH469 | Spatholobus suberectus | Dian Ji Xue Teng Gao Fen | 滇鸡血藤膏粉 |
TCMH1036 | Spatholobus suberectus | Ji Xue Teng | 鸡血藤 |
TCMH1037 | Spatholobus suberectus | Ji Xue Teng Gan Gao | 鸡血藤干膏 |
TCMH1792 | Morus alba | Sang Pi | 桑皮 |
TCMH1797 | Morus alba | Sang Ye | 桑叶 |
TCMH1721 | Panax ginseng | Ren Shen | 人参 |
TCMH1728 | Panax ginseng | Ren Shen Ye | 人参叶 |
TCMH519 | Pogostemon cablin | Du Huo Xiang | 杜藿香 |
TCMH728 | Pogostemon cablin | Guang Huo Xiang | 广藿香 |
TCMH1008 | Pogostemon cablin | Huo Xiang | 藿香 |
TCMH1009 | Pogostemon cablin | Huo Xiang Ye | 藿香叶 |
TCMH1927 | Diospyros kaki | Shi Di | 柿蒂 |
TCMH2082 | Acanthopanax gracilistylus | Teng Wu Jia Gen | 藤五加根 |
TCMH2139 | Acanthopanax gracilistylus | Tu Jia Pi | 土加皮 |
TCMH2152 | Acanthopanax gracilistylus | Tu Wu Jia | 土五加 |
TCMH814 | Nelumbo nucifera | He Geng | 荷梗 |
TCMH825 | Nelumbo nucifera | He Ye | 荷叶 |
TCMH1275 | Nelumbo nucifera | Lian Zi | 莲子 |
TCMH1276 | Nelumbo nucifera | Lian Zi Xin | 莲子心 |
TCMH1598 | Nelumbo nucifera | Ou | 藕 |
TCMH1599 | Nelumbo nucifera | Ou Fen | 藕粉 |
TCMH930 | Arachis hypogaea | Hua Sheng | 花生 |
TCMH931 | Arachis hypogaea | Hua Sheng Mi | 花生米 |
TCMH407 | Salvia miltiorrhiza | Dan Shen | 丹参 |
TCMH408 | Salvia miltiorrhiza | Dan Shen Gan Jin Gao | 丹参干浸膏 |
TCMH2164 | Clematis chinensis | Wei Ling | 威灵 |
TCMH1794 | Morus alba | Sang Shen | 桑葚 |
TCMH1795 | Morus alba | Sang Shen Jin Gao | 桑葚浸膏 |
TCMH1133 | Rosa laevigata | Jin Ying Zi | 金樱子 |
TCMH1134 | Rosa laevigata | Jin Ying Zi Rou | 金樱子肉 |
TCMH1423 | Ophiopogon japonicus | Mai Dong | 麦冬 |
TCMH1424 | Ophiopogon japonicus | Mai Dong Men | 麦冬门 |
TCMH1425 | Ophiopogon japonicus | Mai Dong Rou | 麦冬肉 |
TCMH1489 | Papaver somniferum | Mi Ying Su Ke | 蜜罂粟壳 |
TCMH2514 | Papaver somniferum | Ying Su | 罂粟 |
Ingredient ID: TCMC801
Formula: C29H50O
Common Name | Beta-Sitosterol |
IUPAC Name | (3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
Canonical SMILES | CC[C@@H](C(C)C)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H](C2)O)C |
Standard InCHI | InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1 |
Standard InCHIKey | KZJWDPNRJALLNS-VJSFXXLFSA-N |
External Identifiers | ChEMBL [CHEMBL221542]; PubChem [222284]; |
Reference of Component-Ingredient Pair | 24130033 |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH86 | Ampelopsis japonica | Bai Lian | 白蔹 |
TCMH1862 | Cornus officinalis | Shan Zhu Yu | 山茱萸 |
TCMH2367 | Linum usitatissimum | Ya Ma Zi | 亚麻子 |
TCMH611 | Rubus idaeus | Fu Pen Zi | 覆盆子 |
TCMH1571 | Daphniphyllum calycinum | Niu Er Feng | 牛耳枫 |
TCMH600 | Euonymus fortunei | Fu Fang Teng | 扶芳藤 |
TCMH2006 | Geum japonicum | Shui Yang Mei Gen | 水杨梅根 |
TCMH1673 | Gentiana macrophylla | Qin Jiao | 秦艽 |
TCMH1739 | Ficus microcarpa | Rong Shu Ye | 榕树叶 |
TCMH914 | Sesamum indicum | Hu Ma Ren | 胡麻仁 |
TCMH211 | Atractylodes lancea | Cang Zhu | 苍术 |
TCMH945 | Sophora japonica | Huai Zhi | 槐枝 |
TCMH457 | Euphorbia humifusa | Di Mian Cao | 地绵草 |
TCMH1063 | Curcuma longa | Jiang Huang | 姜黄 |
TCMH284 | Melia toosendan | Chuan Lian Zi | 川楝子 |
TCMH924 | Zanthoxylum bungeanum | Hua Jiao | 花椒 |
TCMH2630 | Citrus aurantium | Zhi Shi | 枳实 |
TCMH1656 | Angelica decursiva | Qian Hu | 前胡 |
TCMH695 | Uncaria rhynchophylla | Gou Teng | 钩藤 |
TCMH1865 | Paeonia obovata | Shao Yao | 芍药 |
TCMH265 | Laggera pterodonta | Chu Ling Dan Cao | 臭灵丹草 |
TCMH2124 | Speranskia tuberculata | Tou Gu Cao | 透骨草 |
TCMH2622 | Strychnos nux-vomica | Zhi Ma Qian Zi | 炙马钱子 |
TCMH2580 | Coptis chinensis | Ze Xi Huang Lian | 择细黄连 |
TCMH1264 | Litchi chinensis | Li Zhi He | 荔枝核 |
TCMH2506 | Ginkgo biloba | Yin Xing Ye | 银杏叶 |
TCMH1011 | Sargentodoxa cuneata | Huo Xue Teng | 活血藤 |
TCMH2166 | Clematis chinensis | Wei Ling Xian | 威灵仙 |
TCMH2495 | Artemisia capillaris | Yin Chen Hao Gan Jin Gao | 茵陈蒿干浸膏 |
TCMH803 | Massa hanshi fermentata | Han Shi | 寒食 |
TCMH2352 | Saussurea involucrata | Xue Lian Hua | 雪莲花 |
TCMH271 | Clerodendrum trichotomum | Chou Wu Tong Ye | 臭梧桐叶 |
TCMH1255 | Tripterygium wilfordii | Lei Gong Teng | 雷公藤 |
TCMH1348 | Liquidambar formosana | Lu Lu Tong | 路路通 |
TCMH1693 | Aristolochia debilis | Qing Mu Xiang | 青木香 |
TCMH2469 | Fritillaria pallidiflora | Yi Bei Mu | 伊贝母 |
TCMH2143 | Sophora flavescens | Tu Ku Shen | 土苦参 |
TCMH1326 | Physeter catodon | Long Xian Xiang | 龙涎香 |
TCMH537 | Centipeda minima | E Bu Shi Cao Nong Suo Ye | 鹅不食草浓缩液 |
TCMH241 | Plantago asiatica | Che Qian Zi | 车前子 |
TCMH2513 | Rhododendron mucronulatum | Ying Shan Hong | 映山红 |
TCMH2134 | Smilax glabra | Tu Fu Ling | 土茯苓 |
TCMH281 | Dipsacus asper | Chuan Duan | 川断 |
TCMH1633 | Taraxacum mongolicum | Pu Gong Ying Jin Gao | 蒲公英浸膏 |
TCMH865 | Carthamus tinctorius | Hong Hua | 红花 |
TCMH2145 | Achyranthes aspera | Tu Niu Xi | 土牛膝 |
TCMH1186 | Lycium chinense | Gou Qi Zi | 枸杞子 |
TCMH120 | Atractylodes macrocephala | Bai Zhu | 白术 |
TCMH568 | Euphorbia hirta | Fei Yang Cao | 飞杨草 |
TCMH845 | Auricularia auricula-judae | Hei Mu Er | 黑木耳 |
TCMH733 | Desmodium styracifolium | Guang Jin Qian Cao | 广金钱草 |
TCMH844 | Breynia fruticosa | Hei Mian Shen | 黑面神 |
TCMH2693 | Fructus gleditsiae abnormalis | Zhu Ya Zao | 猪牙皂 |
TCMH1674 | Gentiana straminea | Qin Jiao Hua | 秦艽花 |
TCMH1562 | Arctium lappa | Niu Bang Zi | 牛蒡子 |
TCMH2244 | Prunella vulgaris | Xia Ku Cao | 夏枯草 |
TCMH1460 | Zanthoxylum nitidum | Mao Liang Mian Zhen | 毛两面针 |
TCMH316 | Ailanthi cortex | Chun Pi | 椿皮 |
TCMH2491 | Alpinia oxyphylla | Yi Zhi Ren | 益智仁 |
TCMH2642 | Gardenia jasminoides | Zhi Zi Jin Gao | 栀子浸膏 |
TCMH2137 | Pogostemon cablin | Tu Huo Xiang | 土藿香 |
TCMH1538 | Baphicacanthus cusia | Nan Ban Lan Gen Jin Gao Fen | 南板蓝根浸膏粉 |
TCMH2715 | Ardisia japonica | Zi Jin Niu | 紫金牛 |
TCMH2238 | Siegesbeckiae herba | Xi Xian Cao | 豨莶草 |
TCMH1929 | Lysionotus pauciflorus | Shi Diao Lan | 石吊兰 |
TCMH1343 | Aloe vera | Lu Hui | 芦荟 |
TCMH561 | Senegalia catechu | Fang Er Cha | 方儿茶 |
TCMH2382 | Naja naja | Yan Jing She | 眼镜蛇 |
TCMH2381 | Daphne genkwa | Yuan Hua Zhi Tiao | 芫花枝条 |
TCMH2702 | Concha mauritiae arabicae | Zi Bei Chi | 紫贝齿 |
TCMH985 | Astragalus membranaceus | Huang Qi Ti Qu Ye | 黄芪提取液 |
TCMH2265 | Cyperus rotundus | Xiang Fu | 香附 |
TCMH2218 | Rubia cordifolia | Qian Cao Teng | 茜草藤 |
TCMH1212 | Melia azedarach | Ku Lian Zi | 苦楝子 |
TCMH2436 | Elaeagnus pungens | Yang Nai Nai Ye | 羊奶奶叶 |
TCMH367 | Caulis sargentodoxae | Da Huo Xue | 大活血 |
TCMH1972 | Dioscorea cirrhosa | Shu Lang | 薯莨 |
TCMH2077 | Prunus persica | Tao Zhi | 桃枝 |
TCMH213 | Boschniakia rossica | Cao Cong Rong | 草苁蓉 |
TCMH1962 | Gymnadenia conopsea | Shou Shen | 手参 |
TCMH2710 | Homo sapiens | Zi He Che | 紫河车 |
TCMH1105 | Trollius chinensis | Jin Lian Hua | 金莲花 |
TCMH957 | Prismatomeris tetrandra | Huang Gen | 黄根 |
TCMH2050 | Punica granatum | Suan Shi Liu | 酸石榴 |
TCMH699 | Eriocaulon buergerianum | Gu Jing Cao | 谷精草 |
TCMH1096 | Inula japonica | Jin Fei Cao | 金沸草 |
TCMH1894 | Pinellia ternata | Sheng Ban Xia | 生半夏 |
TCMH409 | Salvia miltiorrhiza | Dan Shen Jin Gao | 丹参浸膏 |
TCMH215 | Alpinia katsumadai | Cao Dou Kou Ren | 草豆蔻仁 |
TCMH1051 | Piper sarmentosum | Jia 蒟ye | 假蒟叶 |
TCMH700 | Drynaria fortunei | Gu Sui Bu | 骨碎补 |
TCMH445 | Hypericum japonicum | Di Er Cao | 地耳草 |
TCMH2275 | Dracocephalum moldavica | Xiang Qing Lan | 香青兰 |
TCMH2462 | Crataegus pinnatifida | Ye Shan Zha | 野山楂 |
TCMH1872 | Cnidium monnieri | She Ma Zi | 蛇麻子 |
TCMH308 | Dipsacus asperoides | Chuan Xu Duan | 川续断 |
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
TCMH108 | Perilla frutescens | Bai Su Zi | 白苏子 |
TCMH526 | Eucommia ulmoides | Du Zhong Ye | 杜仲叶 |
TCMH1299 | Ganoderma lucidum | Ling Zhi(1) | 灵芝 |
TCMH428 | Codonopsis pilosula | Dang Shen Qing Gao | 党参清膏 |
TCMH1322 | Solanum nigrum | Long Kui | 龙葵 |
TCMH422 | Angelica sinensis | Dang Gui Gan Jin Gao | 当归干浸膏 |
TCMH1839 | Panax ginseng | Shan Shen | 山参 |
TCMH2374 | Phellodendron amurense | Yan Guan Huang Bai | 盐关黄柏 |
TCMH1519 | Oroxylum indicum | Mu Hu Die | 木蝴蝶 |
TCMH1446 | Vaccinium oxycoccos | Man Yue Mei | 蔓越莓 |
TCMH2090 | Gastrodia elata | Tian Ma | 天麻 |
TCMH95 | Aquilaria sinensis | Bai Mu Xiang | 白木香 |
TCMH1546 | Piper wallichii | Nan Teng | 南藤 |
TCMH859 | Ormosia hosiei | Hong Dou | 红豆 |
TCMH2232 | Scutellaria amoena | Xi Nan Huang Qin | 西南黄芩 |
TCMH2571 | Gleditsia sinensis | Zao Jiao Zhen | 皂角针 |
TCMH829 | Semen pharbitidis | Hei Chou | 黑丑 |
TCMH1601 | Nelumbo nucifera | Ou Pian | 藕片 |
TCMH74 | Patrinia villosa | Bai Jiang | 败酱 |
TCMH1615 | Eriobotrya japonica | Pi Ba Ren | 枇杷仁 |
TCMH37 | Smilax china | Ba Qia | 菝葜 |
TCMH1680 | Sinomenium acutum | Qing Feng Teng | 青风藤 |
TCMH287 | Clematidis armandii caulis | Chuan Mu Tong | 川木通 |
TCMH1518 | Chaenomeles sinensis | Mu Gua | 木瓜 |
TCMH2261 | Fritillaria thunbergii | Xiang Bei | 象贝 |
TCMH2485 | Kadsura heteroclita | Yi Xing Nan Wu Wei Zi | 异型南五味子 |
TCMH2192 | Prunus mume | Wu Mei Rou | 乌梅肉 |
TCMH1285 | Orobanche coerulescens | Lie Dang | 列当 |
TCMH2023 | Chloranthus holostegius | Si Kuai Wa | 四块瓦 |
TCMH670 | Ligusticum sinense | Gao Ben | 藁本 |
TCMH1033 | Centella asiatica | Ji Xue Cao | 积雪草 |
TCMH1823 | Alpinia zerumbet | Shan Jiang | 山姜 |
TCMH565 | Stephania tetrandra | Fang Ji | 防己 |
TCMH1277 | Alpinia officinarum | Liang Jiang | 良姜 |
TCMH1117 | Rhizoma fagopyri cymosi | Jin Qiao Mai | 金荞麦 |
TCMH2086 | Trichosanthes kirilowii | Tian Hua Fen | 天花粉 |
TCMH1958 | Diospyros kaki | Shi Ye | 柿叶 |
TCMH2056 | Cynomorium songaricum | Suo Yang | 锁阳 |
TCMH1396 | Portulaca oleracea | Ma Chi Xian | 马齿苋 |
TCMH1371 | Arachis hypogaea | Luo Hua Sheng Zhi Ye | 落花生枝叶 |
TCMH2114 | Adiantum capillus-veneris | Tie Xian Cao | 铁线草 |
TCMH2297 | Cirsium setosum | Xiao Ji | 小蓟 |
TCMH1090 | Brassica juncea | Jie Zi | 芥子 |
TCMH1539 | Cucurbita moschata | Nan Gua | 南瓜 |
TCMH1766 | Sparganium stoloniferum | San Ling | 三棱 |
TCMH1032 | Impatiens balsamina | Ji Xing Zi | 急性子 |
TCMH1660 | Senecio scandens | Qian Li Guang | 千里光 |
TCMH1503 | Eclipta prostrata | Mo Han Lian | 墨旱莲 |
TCMH863 | Salvia prionitis | Hong Gen Cao | 红根草 |
TCMH1121 | Cardiospermum halicacabum | Jin Si Ku Lian | 金丝苦楝 |
TCMH2698 | Valeriana officinalis | Zhua Di Hu | 抓地虎 |
TCMH500 | Benincasa hispida | Dong Gua Zi | 冬瓜子 |
TCMH1903 | Zingiber officinale | Sheng Jiang | 生姜 |
TCMH2356 | Daemonorops draco | Xue Xie | 血蝎 |
TCMH2370 | Commelina communis | Ya Zhi Cao | 鸭跖草 |
TCMH1448 | Mangifera indica | Mang Guo Ye | 芒果叶 |
TCMH447 | Illicium difengpi | Di Feng Pi | 地枫皮 |
TCMH1511 | Momordica cochinchinensis | Mu Bie Zi | 木鳖子 |
TCMH2371 | Juniperus formosana | Yan Bai | 岩柏 |
TCMH1483 | Tussilago farfara | Mi Kuan Dong Hua | 蜜款冬花 |
TCMH1658 | Euphorbia lathyris | Qian Jin Zi | 千金子 |
TCMH494 | Cordyceps sinensis | Dong Chong Xia Cao | 冬虫夏草 |
TCMH57 | Wolfiporia cocos | Bai Fu Ling | 白茯苓 |
TCMH1588 | Achyranthes bidentata | Niu Xi | 牛膝 |
TCMH2132 | Lagotis brevituba | Tu Er Cao | 兔耳草 |
TCMH1017 | Oxytropis myriophylla | Ji Dou | 棘豆 |
TCMH76 | Thlaspi arvense | Bai Jiang Cao | 败酱草 |
TCMH1179 | Citri exocarpium rubrum | Ju Hong | 橘红 |
TCMH148 | Glehnia littoralis | Bei Sha Shen Liu Jin Gao | 北沙参流浸膏 |
TCMH348 | Lobelia chinensis | Da Ban Bian Lian | 大半边莲 |
TCMH2489 | Solidago decurrens | Yi Zhi Hao | 一枝蒿 |
TCMH562 | Saposhnikovia divaricata | Fang Feng | 防风 |
TCMH1272 | Forsythia suspensa | Lian Qiao | 连翘 |
TCMH901 | Saxifraga stolonifera | Hu Er Cao | 虎耳草 |
TCMH114 | Platycladus orientalis | Bai Ye | 柏叶 |
TCMH203 | Acorus calamus | Cang Chang Pu | 藏菖蒲 |
TCMH906 | Viscum coloratum | Hu Ji Sheng | 槲寄生 |
TCMH1804 | Amomum villosum | Sha Ren Ye | 砂仁叶 |
TCMH1305 | Laggera alata | Liu Ling Ju | 六棱菊 |
TCMH2248 | Corydalis decumbens | Xia Tian Wu | 夏天无 |
TCMH1184 | Citrus reticulata | Ju Pi | 橘皮 |
TCMH2135 | Glycyrrhiza uralensis | Tu Gan Cao | 土甘草 |
TCMH1678 | Indigo naturalis | Qing Dai | 青黛 |
TCMH2213 | Ipomoea cairica | Wu Zhao Long | 五爪龙 |
TCMH2553 | Scrophularia ningpoensis | Yuan Shen | 元参 |
TCMH79 | Sinapis alba | Bai Jie Zi | 白芥子 |
TCMH2069 | Aconitum tanguticum | Tang Gu Te Wu Tou | 唐古特乌头 |
TCMH1777 | Panax notoginseng | San Qi Ye Jing | 三七叶茎 |
TCMH214 | Alpinia katsumadai | Cao Dou Kou | 草豆蔻 |
TCMH385 | Sargentodoxa cuneata | Da Xue Teng | 大血藤 |
TCMH1846 | Artemisia capillaris | Shan Yin Chen | 山茵陈 |
TCMH2154 | Artemisia capillaris | Tu Yin Chen Hao | 土茵陈蒿 |
TCMH2494 | Artemisia capillaris | Yin Chen Hao | 茵陈蒿 |
TCMH590 | Impatiens balsamina | Feng Xian Hua | 凤仙花 |
TCMH591 | Impatiens balsamina | Feng Xian Tou Gu Cao | 凤仙透骨草 |
TCMH1803 | Amomum villosum | Sha Ren | 砂仁 |
TCMH737 | Crataegus pinnatifida | Guang Shan Zha | 广山楂 |
TCMH1848 | Crataegus pinnatifida | Shan Zha | 山楂 |
TCMH1849 | Crataegus pinnatifida | Shan Zha Chou Gao | 山楂稠膏 |
TCMH1852 | Crataegus pinnatifida | Shan Zha Qing Gao | 山楂清膏 |
TCMH1853 | Crataegus pinnatifida | Shan Zha Tan | 山楂炭 |
TCMH1175 | Cornus officinalis | Jiu Yu Rou | 酒萸肉 |
TCMH918 | Elaeagnus pungens | Hu Tui Zi Ye | 胡颓子叶 |
TCMH122 | Lobelia chinensis | Ban Bian Lian | 半边莲 |
TCMH2071 | Prunus persica | Tao | 桃 |
TCMH2073 | Prunus persica | Tao Ren | 桃仁 |
TCMH2074 | Prunus persica | Tao Ren Shuang | 桃仁霜 |
TCMH1584 | Achyranthes bidentata | Niu Teng | 牛藤 |
TCMH421 | Angelica sinensis | Dang Gui | 当归 |
TCMH1866 | Cnidium monnieri | She Chuang Zi | 蛇床子 |
TCMH426 | Codonopsis pilosula | Dang Shen | 党参 |
TCMH524 | Eucommia ulmoides | Du Zhong | 杜仲 |
TCMH525 | Eucommia ulmoides | Du Zhong Tan | 杜仲炭 |
TCMH1225 | Valeriana officinalis | Kuan Ye Xie Cao | 宽叶缬草 |
TCMH2310 | Valeriana officinalis | Xie Cao | 缬草 |
TCMH498 | Benincasa hispida | Dong Gua Pi | 冬瓜皮 |
TCMH52 | Semen pharbitidis | Bai Chou | 白丑 |
TCMH1185 | Lycium chinense | Gou Qi | 枸杞 |
TCMH1734 | Homo sapiens | Ren Zhong Bai | 人中白 |
TCMH592 | Liquidambar formosana | Feng Xiang Ye | 枫香叶 |
TCMH594 | Liquidambar formosana | Feng Xiang Zhi Chou Gao | 枫香脂稠膏 |
TCMH1738 | Ficus microcarpa | Rong Shu Xu | 榕树须 |
TCMH2098 | Saussurea involucrata | Tian Shan Xue Lian Hua | 天山雪莲花 |
TCMH2351 | Saussurea involucrata | Xue Lian | 雪莲 |
TCMH270 | Clerodendrum trichotomum | Chou Wu Tong | 臭梧桐 |
TCMH310 | Melia azedarach | Chuan Lian | 川楝 |
TCMH1211 | Melia azedarach | Ku Lian Pi | 苦楝皮 |
TCMH130 | Pinellia ternata | Ban Xia | 半夏 |
TCMH131 | Pinellia ternata | Ban Xia Qu | 半夏曲 |
TCMH1677 | Pinellia ternata | Qing Ban Xia | 清半夏 |
TCMH1215 | Sophora flavescens | Ku Shen | 苦参 |
TCMH2080 | Sophora flavescens | Teng Ku Shen | 藤苦参 |
TCMH2369 | Gleditsia sinensis | Ya Zao | 牙皂 |
TCMH2569 | Gleditsia sinensis | Zao Jia | 皂荚 |
TCMH431 | Achyranthes aspera | Dao Kou Cao | 倒扣草 |
TCMH938 | Sophora japonica | Huai Hua | 槐花 |
TCMH940 | Sophora japonica | Huai Jiao | 槐角 |
TCMH941 | Sophora japonica | Huai Mi | 槐米 |
TCMH1943 | Punica granatum | Shi Liu | 石榴 |
TCMH1944 | Punica granatum | Shi Liu Pi | 石榴皮 |
TCMH1945 | Punica granatum | Shi Liu Zi | 石榴子 |
TCMH258 | Paeonia obovata | Chi Shao | 赤芍 |
TCMH705 | Trichosanthes kirilowii | Gua Lou | 瓜蒌 |
TCMH706 | Trichosanthes kirilowii | Gua Lou Pi | 瓜蒌皮 |
TCMH707 | Trichosanthes kirilowii | Gua Lou Ren | 瓜蒌仁 |
TCMH708 | Trichosanthes kirilowii | Gua Lou Ren Shuang | 瓜蒌仁霜 |
TCMH709 | Trichosanthes kirilowii | Gua Lou Shi | 栝蒌实 |
TCMH711 | Trichosanthes kirilowii | Gua Lou Gen | 栝楼根 |
TCMH712 | Trichosanthes kirilowii | Gua Lou Ren(1) | 栝楼仁 |
TCMH1770 | Panax notoginseng | San Qi Gan Jin Gao | 三七干浸膏 |
TCMH1771 | Panax notoginseng | San Qi Gao Fen | 三七膏粉 |
TCMH1772 | Panax notoginseng | San Qi Hua | 三七花 |
TCMH1774 | Panax notoginseng | San Qi Jing Ye | 三七茎叶 |
TCMH1776 | Panax notoginseng | San Qi Ye | 三七叶 |
TCMH2488 | Alpinia oxyphylla | Yi Zhi | 益智 |
TCMH672 | Alpinia officinarum | Gao Liang Jiang | 高良姜 |
TCMH673 | Alpinia officinarum | Gao Liang Jiang You | 高良姜油 |
TCMH309 | Curcuma longa | Chuan Yu Jin | 川郁金 |
TCMH717 | Phellodendron amurense | Guan Huang Bai | 关黄柏 |
TCMH949 | Phellodendron amurense | Huang Bai | 黄柏 |
TCMH950 | Phellodendron amurense | Huang Bai Fen | 黄柏粉 |
TCMH951 | Phellodendron amurense | Huang Bai Tan | 黄柏炭 |
TCMH848 | Sesamum indicum | Hei Zhi Ma | 黑芝麻 |
TCMH913 | Sesamum indicum | Hu Ma | 胡麻 |
TCMH981 | Astragalus membranaceus | Huang Qi | 黄芪 |
TCMH983 | Astragalus membranaceus | Huang Qi Gan Jin Gao | 黄芪干浸膏 |
TCMH984 | Astragalus membranaceus | Huang Qi Jin Gao | 黄芪浸膏 |
TCMH1397 | Aristolochia debilis | Ma Dou Ling | 马兜铃 |
TCMH1296 | Ganoderma lucidum | Ling Zhi Jin Gao | 灵芝浸膏 |
TCMH1178 | Citrus reticulata | Ju He | 橘核 |
TCMH978 | Taraxacum mongolicum | Huang Miao | 黄苗 |
TCMH1632 | Taraxacum mongolicum | Pu Gong Ying | 蒲公英 |
TCMH1405 | Strychnos nux-vomica | Ma Qian Zi | 马钱子 |
TCMH1406 | Strychnos nux-vomica | Ma Qian Zi Fen | 马钱子粉 |
TCMH1045 | Piper sarmentosum | Jia Ju | 假蒟 |
TCMH93 | Prunus mume | Bai Mei Hua | 白梅花 |
TCMH2191 | Prunus mume | Wu Mei | 乌梅 |
TCMH264 | Laggera pterodonta | Chu Ling Dan | 臭灵丹 |
TCMH1721 | Panax ginseng | Ren Shen | 人参 |
TCMH1728 | Panax ginseng | Ren Shen Ye | 人参叶 |
TCMH519 | Pogostemon cablin | Du Huo Xiang | 杜藿香 |
TCMH728 | Pogostemon cablin | Guang Huo Xiang | 广藿香 |
TCMH1008 | Pogostemon cablin | Huo Xiang | 藿香 |
TCMH1009 | Pogostemon cablin | Huo Xiang Ye | 藿香叶 |
TCMH1927 | Diospyros kaki | Shi Di | 柿蒂 |
TCMH60 | Ginkgo biloba | Bai Guo | 白果 |
TCMH61 | Ginkgo biloba | Bai Guo Ren | 白果仁 |
TCMH2005 | Geum japonicum | Shui Yang Mei | 水杨梅 |
TCMH814 | Nelumbo nucifera | He Geng | 荷梗 |
TCMH825 | Nelumbo nucifera | He Ye | 荷叶 |
TCMH1275 | Nelumbo nucifera | Lian Zi | 莲子 |
TCMH1276 | Nelumbo nucifera | Lian Zi Xin | 莲子心 |
TCMH1598 | Nelumbo nucifera | Ou | 藕 |
TCMH1599 | Nelumbo nucifera | Ou Fen | 藕粉 |
TCMH930 | Arachis hypogaea | Hua Sheng | 花生 |
TCMH931 | Arachis hypogaea | Hua Sheng Mi | 花生米 |
TCMH1537 | Baphicacanthus cusia | Nan Ban Lan Gen | 南板蓝根 |
TCMH1223 | Tussilago farfara | Kuan Dong Hua | 款冬花 |
TCMH283 | Coptis chinensis | Chuan Huang Lian | 川黄连 |
TCMH972 | Coptis chinensis | Huang Lian | 黄连 |
TCMH973 | Coptis chinensis | Huang Lian Gan Jin Gao | 黄连干浸膏 |
TCMH975 | Coptis chinensis | Huang Lian Xu | 黄连须 |
TCMH1064 | Coptis chinensis | Jiang Huang Lian | 姜黄连 |
TCMH1161 | Coptis chinensis | Jiu Huang Lian | 酒黄连 |
TCMH2330 | Coptis chinensis | Xiong Huang Lian | 雄黄连 |
TCMH2531 | Coptis chinensis | Yu Huang Lian | 萸黄连 |
TCMH454 | Euphorbia humifusa | Di Jin Cao | 地锦草 |
TCMH407 | Salvia miltiorrhiza | Dan Shen | 丹参 |
TCMH408 | Salvia miltiorrhiza | Dan Shen Gan Jin Gao | 丹参干浸膏 |
TCMH2164 | Clematis chinensis | Wei Ling | 威灵 |
TCMH628 | Glycyrrhiza uralensis | Gan Cao | 甘草 |
TCMH629 | Glycyrrhiza uralensis | Gan Cao Fen | 甘草粉 |
TCMH630 | Glycyrrhiza uralensis | Gan Cao Gan Gao | 甘草干膏 |
TCMH631 | Glycyrrhiza uralensis | Gan Cao Gan Gao Fen | 甘草干膏粉 |
TCMH632 | Glycyrrhiza uralensis | Gan Cao Gan Jin Gao | 甘草干浸膏 |
TCMH633 | Glycyrrhiza uralensis | Gan Cao Gao | 甘草膏 |
TCMH634 | Glycyrrhiza uralensis | Gan Cao Jie | 甘草节 |
TCMH635 | Glycyrrhiza uralensis | Gan Cao Jin Gao | 甘草浸膏 |
TCMH636 | Glycyrrhiza uralensis | Gan Cao Liu Jin Gao | 甘草流浸膏 |
TCMH1475 | Glycyrrhiza uralensis | Mi Gan Cao | 蜜甘草 |
TCMH1899 | Glycyrrhiza uralensis | Sheng Gan Cao | 生甘草 |
TCMH253 | Citrus aurantium | Cheng Pi | 橙皮 |
TCMH2613 | Citrus aurantium | Zhi Geng | 枳梗 |
TCMH2618 | Citrus aurantium | Zhi Ke | 枳壳 |
TCMH2619 | Citrus aurantium | Zhi Ke Gan Jin Gao | 枳壳干浸膏 |
TCMH147 | Glehnia littoralis | Bei Sha Shen | 北沙参 |
TCMH536 | Centipeda minima | E Bu Shi Cao | 鹅不食草 |
TCMH1856 | Gardenia jasminoides | Shan Zhi | 山栀 |
TCMH2641 | Gardenia jasminoides | Zhi Zi | 栀子 |
TCMH344 | Daphne genkwa | Cu Yuan Hua | 醋芫花 |
TCMH2378 | Daphne genkwa | Yuan Hua | 芫花 |
TCMH2379 | Daphne genkwa | Yuan Hua Gen | 芫花根 |
TCMH2380 | Daphne genkwa | Yuan Hua Tiao | 芫花条 |
TCMH2343 | Scrophularia ningpoensis | Xuan Shen | 玄参 |
Ingredient ID: TCMC6583
Formula: C8H14N2O2
Common Name | Cyclo-(Ala-Val) |
IUPAC Name | (3S,6R)-3-methyl-6-propan-2-ylpiperazine-2,5-dione |
Canonical SMILES | C[C@@H]1NC(=O)[C@H](NC1=O)C(C)C |
Standard InCHI | InChI=1S/C8H14N2O2/c1-4(2)6-8(12)9-5(3)7(11)10-6/h4-6H,1-3H3,(H,9,12)(H,10,11)/t5-,6+/m0/s1 |
Standard InCHIKey | ORLDMMKUTCCBSM-NTSWFWBYSA-N |
External Identifiers | ChEMBL [N/A]; PubChem [23278158]; |
Reference of Component-Ingredient Pair | N/A |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
TCMH1768 | Panax notoginseng | San Qi | 三七 |
Ingredient ID: TCMC5449
Formula: C42H64O15
Common Name | 3-O-Β-D-Galactopyranosyl-(1→2)-Β-D-Glucuronopyranosyl-Gypsogenin |
IUPAC Name | (2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-8a-carboxy-4-formyl-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid |
Canonical SMILES | OC[C@H]1O[C@@H](O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2O)O)C(=O)[O-])O[C@H]2CC[C@]3([C@H]([C@]2(C)C=O)CC[C@@]2([C@@H]3CC=C3[C@@]2(C)CC[C@@]2([C@H]3CC(C)(C)CC2)C(=O)[O-])C)C)[C@@H]([C@H]([C@H]1O)O)O |
Standard InCHI | InChI=1S/C42H64O15/c1-37(2)13-15-42(36(52)53)16-14-40(5)20(21(42)17-37)7-8-24-38(3)11-10-25(39(4,19-44)23(38)9-12-41(24,40)6)55-35-32(29(48)28(47)31(56-35)33(50)51)57-34-30(49)27(46)26(45)22(18-43)54-34/h7,19,21-32,34-35,43,45-49H,8-18H2,1-6H3,(H,50,51)(H,52,53)/p-2/t21-,22+,23+,24+,25-,26-,27-,28-,29-,30+,31-,32+,34-,35+,38-,39-,40+,41+,42-/m0/s1 |
Standard InCHIKey | GBNOIXDJNQHMIV-CHTALKLSSA-L |
External Identifiers | ChEMBL [N/A]; PubChem [10581231]; |
Reference of Component-Ingredient Pair | 17655146 |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
Ingredient ID: TCMC4927
Formula: C8H12N2O2
Common Name | Cyclo-(Ala-Pro) |
IUPAC Name | (3S,8aR)-3-methyl-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione |
Canonical SMILES | C[C@@H]1NC(=O)[C@@H]2N(C1=O)CCC2 |
Standard InCHI | InChI=1S/C8H12N2O2/c1-5-8(12)10-4-2-3-6(10)7(11)9-5/h5-6H,2-4H2,1H3,(H,9,11)/t5-,6+/m0/s1 |
Standard InCHIKey | WSLYCILIEOFQPK-NTSWFWBYSA-N |
External Identifiers | ChEMBL [CHEMBL2229106]; PubChem [5325711]; |
Reference of Component-Ingredient Pair | N/A |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
TCMH1768 | Panax notoginseng | San Qi | 三七 |
Ingredient ID: TCMC4142
Formula: C6H10N2O2
Common Name | Cyclo-(Ala-Ala) |
IUPAC Name | (3R,6S)-3,6-dimethylpiperazine-2,5-dione |
Canonical SMILES | C[C@@H]1NC(=O)[C@H](NC1=O)C |
Standard InCHI | InChI=1S/C6H10N2O2/c1-3-5(9)8-4(2)6(10)7-3/h3-4H,1-2H3,(H,7,10)(H,8,9)/t3-,4+ |
Standard InCHIKey | WWISPHBAYBECQZ-ZXZARUISSA-N |
External Identifiers | ChEMBL [N/A]; PubChem [676438]; |
Reference of Component-Ingredient Pair | N/A |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
Ingredient ID: TCMC384
Formula: C8H7NO3S
Common Name | 2-Methyl-1,1-Dioxo-1,2-Benzothiazol-3-One |
IUPAC Name | 2-methyl-1,1-dioxo-1,2-benzothiazol-3-one |
Canonical SMILES | O=C1c2ccccc2S(=O)(=O)N1C |
Standard InCHI | InChI=1S/C8H7NO3S/c1-9-8(10)6-4-2-3-5-7(6)13(9,11)12/h2-5H,1H3 |
Standard InCHIKey | DDIIAJRLFATEEE-UHFFFAOYSA-N |
External Identifiers | ChEMBL [CHEMBL131790]; PubChem [27290]; |
Reference of Component-Ingredient Pair | N/A |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
Ingredient ID: TCMC3391
Formula: C30H46O5
Common Name | Quillaic Acid |
IUPAC Name | (4aR,5R,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-5,10-dihydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
Canonical SMILES | O=C[C@]1(C)[C@@H](O)CC[C@]2([C@H]1CC[C@@]1([C@@H]2CC=C2[C@@]1(C)C[C@@H](O)[C@@]1([C@H]2CC(CC1)(C)C)C(=O)[O-])C)C |
Standard InCHI | InChI=1S/C30H46O5/c1-25(2)13-14-30(24(34)35)19(15-25)18-7-8-21-26(3)11-10-22(32)27(4,17-31)20(26)9-12-28(21,5)29(18,6)16-23(30)33/h7,17,19-23,32-33H,8-16H2,1-6H3,(H,34,35)/p-1/t19-,20+,21+,22-,23+,26-,27-,28+,29+,30+/m0/s1 |
Standard InCHIKey | MQUFAARYGOUYEV-UAWZMHPWSA-M |
External Identifiers | ChEMBL [CHEMBL260060]; PubChem [101810]; |
Reference of Component-Ingredient Pair | 25534953 |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
Ingredient ID: TCMC2540
Formula: C10H16N2O2
Common Name | Cyclo(L-Val-L-Pro) |
IUPAC Name | (3S,8aS)-3-propan-2-yl-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione |
Canonical SMILES | CC([C@@H]1N=C(O)[C@H]2N(C1=O)CCC2)C |
Standard InCHI | InChI=1S/C10H16N2O2/c1-6(2)8-10(14)12-5-3-4-7(12)9(13)11-8/h6-8H,3-5H2,1-2H3,(H,11,13)/t7-,8-/m0/s1 |
Standard InCHIKey | XLUAWXQORJEMBD-YUMQZZPRSA-N |
External Identifiers | ChEMBL [CHEMBL499570]; PubChem [6992261]; |
Reference of Component-Ingredient Pair | N/A |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
TCMH138 | Syringa reticulata | Bao Ma Zi Pi | 暴马子皮 |
TCMH494 | Cordyceps sinensis | Dong Chong Xia Cao | 冬虫夏草 |
Ingredient ID: TCMC2513
Formula: C10H16N2O2
Common Name | Cyclo(L-Val-D-Pro) |
IUPAC Name | (3S,8aR)-3-propan-2-yl-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione |
Canonical SMILES | CC([C@@H]1N=C(O)[C@@H]2N(C1=O)CCC2)C |
Standard InCHI | InChI=1S/C10H16N2O2/c1-6(2)8-10(14)12-5-3-4-7(12)9(13)11-8/h6-8H,3-5H2,1-2H3,(H,11,13)/t7-,8+/m1/s1 |
Standard InCHIKey | XLUAWXQORJEMBD-SFYZADRCSA-N |
External Identifiers | ChEMBL [CHEMBL454463]; PubChem [6992260]; |
Reference of Component-Ingredient Pair | N/A |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
TCMH1777 | Panax notoginseng | San Qi Ye Jing | 三七叶茎 |
TCMH1770 | Panax notoginseng | San Qi Gan Jin Gao | 三七干浸膏 |
TCMH1771 | Panax notoginseng | San Qi Gao Fen | 三七膏粉 |
TCMH1772 | Panax notoginseng | San Qi Hua | 三七花 |
TCMH1774 | Panax notoginseng | San Qi Jing Ye | 三七茎叶 |
TCMH1776 | Panax notoginseng | San Qi Ye | 三七叶 |
Ingredient ID: TCMC2111
Formula: C4H6O4
Common Name | Succinic Acid |
IUPAC Name | butanedioic acid |
Canonical SMILES | OC(=O)CCC(=O)O |
Standard InCHI | InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8) |
Standard InCHIKey | KDYFGRWQOYBRFD-UHFFFAOYSA-N |
External Identifiers | ChEMBL [CHEMBL576]; PubChem [1110]; |
Reference of Component-Ingredient Pair | 29968805 |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH2407 | Bupleurum chinense | Yan Tai Chai Hu | 烟台柴胡 |
TCMH1939 | Combretum indicum | Shi Jun Zi Ren | 使君子仁 |
TCMH101 | Chelidonium majus | Bai Qu Cai | 白屈菜 |
TCMH1144 | Schizonepetae herba | Jing Jie Tan | 荆芥炭 |
TCMH103 | Thesium chinense | Bai Rui Cao | 百蕊草 |
TCMH2134 | Smilax glabra | Tu Fu Ling | 土茯苓 |
TCMH281 | Dipsacus asper | Chuan Duan | 川断 |
TCMH1740 | Cistanche deserticola | Rou Cong Rong | 肉苁蓉 |
TCMH2137 | Pogostemon cablin | Tu Huo Xiang | 土藿香 |
TCMH2328 | Conyza blinii | Xiong Dan Fen | 熊胆粉 |
TCMH2238 | Siegesbeckiae herba | Xi Xian Cao | 豨莶草 |
TCMH1682 | Artemisia carvifolia | Qing Hao Zi | 青蒿子 |
TCMH1343 | Aloe vera | Lu Hui | 芦荟 |
TCMH1498 | Ranunculus ternatus | Mao Zhao Cao | 猫爪草 |
TCMH1212 | Melia azedarach | Ku Lian Zi | 苦楝子 |
TCMH1649 | Toxicodendron succedaneum | Qi Shu Gen | 漆树根 |
TCMH2710 | Homo sapiens | Zi He Che | 紫河车 |
TCMH2050 | Punica granatum | Suan Shi Liu | 酸石榴 |
TCMH409 | Salvia miltiorrhiza | Dan Shen Jin Gao | 丹参浸膏 |
TCMH2275 | Dracocephalum moldavica | Xiang Qing Lan | 香青兰 |
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
TCMH422 | Angelica sinensis | Dang Gui Gan Jin Gao | 当归干浸膏 |
TCMH1839 | Panax ginseng | Shan Shen | 山参 |
TCMH1519 | Oroxylum indicum | Mu Hu Die | 木蝴蝶 |
TCMH1446 | Vaccinium oxycoccos | Man Yue Mei | 蔓越莓 |
TCMH2090 | Gastrodia elata | Tian Ma | 天麻 |
TCMH388 | Ziziphus jujuba | Da Zao | 大枣 |
TCMH2232 | Scutellaria amoena | Xi Nan Huang Qin | 西南黄芩 |
TCMH37 | Smilax china | Ba Qia | 菝葜 |
TCMH49 | Stemona tuberosa | Bai Bu Liu Jin Gao | 百部流浸膏 |
TCMH1518 | Chaenomeles sinensis | Mu Gua | 木瓜 |
TCMH1966 | Rehmannia glutinosa | Shu Di Huang | 熟地黄 |
TCMH2192 | Prunus mume | Wu Mei Rou | 乌梅肉 |
TCMH1285 | Orobanche coerulescens | Lie Dang | 列当 |
TCMH1033 | Centella asiatica | Ji Xue Cao | 积雪草 |
TCMH2362 | Artemisia lactiflora | Ya Jiao Ai | 鸭脚艾 |
TCMH1117 | Rhizoma fagopyri cymosi | Jin Qiao Mai | 金荞麦 |
TCMH1958 | Diospyros kaki | Shi Ye | 柿叶 |
TCMH1038 | Spatholobus suberectus | Ji Xue Teng Gao | 鸡血藤膏 |
TCMH1766 | Sparganium stoloniferum | San Ling | 三棱 |
TCMH205 | Xanthium sibiricum | Cang Er Cao | 苍耳草 |
TCMH2371 | Juniperus formosana | Yan Bai | 岩柏 |
TCMH1483 | Tussilago farfara | Mi Kuan Dong Hua | 蜜款冬花 |
TCMH494 | Cordyceps sinensis | Dong Chong Xia Cao | 冬虫夏草 |
TCMH2132 | Lagotis brevituba | Tu Er Cao | 兔耳草 |
TCMH1535 | Equisetum hiemale | Mu Zei | 木贼 |
TCMH348 | Lobelia chinensis | Da Ban Bian Lian | 大半边莲 |
TCMH901 | Saxifraga stolonifera | Hu Er Cao | 虎耳草 |
TCMH1635 | Typha angustata | Pu Huang Jin Gao | 蒲黄浸膏 |
TCMH2110 | Lespedeza cuneata | Tie Sao Zhou | 铁扫帚 |
TCMH2282 | Citrus medica | Xiang Yuan Pi | 香橼皮 |
TCMH122 | Lobelia chinensis | Ban Bian Lian | 半边莲 |
TCMH421 | Angelica sinensis | Dang Gui | 当归 |
TCMH2281 | Citrus medica | Xiang Yuan | 香橼 |
TCMH204 | Xanthium sibiricum | Cang Er | 苍耳 |
TCMH1734 | Homo sapiens | Ren Zhong Bai | 人中白 |
TCMH310 | Melia azedarach | Chuan Lian | 川楝 |
TCMH1211 | Melia azedarach | Ku Lian Pi | 苦楝皮 |
TCMH46 | Stemona tuberosa | Bai Bu | 百部 |
TCMH47 | Stemona tuberosa | Bai Bu Gan Gao | 百部干膏 |
TCMH48 | Stemona tuberosa | Bai Bu Jin Gao | 百部浸膏 |
TCMH1943 | Punica granatum | Shi Liu | 石榴 |
TCMH1944 | Punica granatum | Shi Liu Pi | 石榴皮 |
TCMH1945 | Punica granatum | Shi Liu Zi | 石榴子 |
TCMH1681 | Artemisia carvifolia | Qing Hao | 青蒿 |
TCMH469 | Spatholobus suberectus | Dian Ji Xue Teng Gao Fen | 滇鸡血藤膏粉 |
TCMH1036 | Spatholobus suberectus | Ji Xue Teng | 鸡血藤 |
TCMH1037 | Spatholobus suberectus | Ji Xue Teng Gan Gao | 鸡血藤干膏 |
TCMH93 | Prunus mume | Bai Mei Hua | 白梅花 |
TCMH2191 | Prunus mume | Wu Mei | 乌梅 |
TCMH1721 | Panax ginseng | Ren Shen | 人参 |
TCMH1728 | Panax ginseng | Ren Shen Ye | 人参叶 |
TCMH228 | Bupleurum chinense | Chai Hu | 柴胡 |
TCMH229 | Bupleurum chinense | Chai Hu Jin Gao | 柴胡浸膏 |
TCMH230 | Bupleurum chinense | Chai Hu Shao | 柴胡梢 |
TCMH519 | Pogostemon cablin | Du Huo Xiang | 杜藿香 |
TCMH728 | Pogostemon cablin | Guang Huo Xiang | 广藿香 |
TCMH1008 | Pogostemon cablin | Huo Xiang | 藿香 |
TCMH1009 | Pogostemon cablin | Huo Xiang Ye | 藿香叶 |
TCMH1927 | Diospyros kaki | Shi Di | 柿蒂 |
TCMH2327 | Conyza blinii | Xiong Dan | 熊胆 |
TCMH1223 | Tussilago farfara | Kuan Dong Hua | 款冬花 |
TCMH1634 | Typha angustata | Pu Huang | 蒲黄 |
TCMH407 | Salvia miltiorrhiza | Dan Shen | 丹参 |
TCMH408 | Salvia miltiorrhiza | Dan Shen Gan Jin Gao | 丹参干浸膏 |
TCMH8 | Rehmannia glutinosa | Ai Di Huang | 矮地黄 |
TCMH451 | Rehmannia glutinosa | Di Huang | 地黄 |
TCMH453 | Rehmannia glutinosa | Di Huang Tan | 地黄炭 |
TCMH643 | Rehmannia glutinosa | Gan Di Huang | 干地黄 |
TCMH2017 | Artemisia lactiflora | Si Ji Cai | 四季菜 |
Ingredient ID: TCMC1582
Formula: C8H8O3
Common Name | Methylparaben |
IUPAC Name | methyl 4-hydroxybenzoate |
Canonical SMILES | COC(=O)c1ccc(cc1)O |
Standard InCHI | InChI=1S/C8H8O3/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5,9H,1H3 |
Standard InCHIKey | LXCFILQKKLGQFO-UHFFFAOYSA-N |
External Identifiers | ChEMBL [CHEMBL325372]; PubChem [7456]; |
Reference of Component-Ingredient Pair | N/A |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH600 | Euonymus fortunei | Fu Fang Teng | 扶芳藤 |
TCMH1628 | Fructus psoraleae corylifoliae | Po Gu Zhi | 破故纸 |
TCMH271 | Clerodendrum trichotomum | Chou Wu Tong Ye | 臭梧桐叶 |
TCMH1278 | Radix zanthoxyli | Liang Mian Zhen | 两面针 |
TCMH2513 | Rhododendron mucronulatum | Ying Shan Hong | 映山红 |
TCMH213 | Boschniakia rossica | Cao Cong Rong | 草苁蓉 |
TCMH2710 | Homo sapiens | Zi He Che | 紫河车 |
TCMH1105 | Trollius chinensis | Jin Lian Hua | 金莲花 |
TCMH1122 | Psammosilene tunicoides | Jin Tie Suo | 金铁锁 |
TCMH1299 | Ganoderma lucidum | Ling Zhi(1) | 灵芝 |
TCMH2226 | Stigma croci | Xi Hong Hua | 西红花 |
TCMH95 | Aquilaria sinensis | Bai Mu Xiang | 白木香 |
TCMH302 | Andrographis paniculata | Chuan Xin Lian Nong Suo Ye | 穿心莲浓缩液 |
TCMH1539 | Cucurbita moschata | Nan Gua | 南瓜 |
TCMH2356 | Daemonorops draco | Xue Xie | 血蝎 |
TCMH1305 | Laggera alata | Liu Ling Ju | 六棱菊 |
TCMH1734 | Homo sapiens | Ren Zhong Bai | 人中白 |
TCMH270 | Clerodendrum trichotomum | Chou Wu Tong | 臭梧桐 |
TCMH1296 | Ganoderma lucidum | Ling Zhi Jin Gao | 灵芝浸膏 |
TCMH298 | Andrographis paniculata | Chuan Xin Lian | 穿心莲 |
TCMH299 | Andrographis paniculata | Chuan Xin Lian Gan Jin Gao | 穿心莲干浸膏 |
TCMH300 | Andrographis paniculata | Chuan Xin Lian Jin Gao | 穿心莲浸膏 |
Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TCMC384 | C8H7NO3S | 2-Methyl-1,1-Dioxo-1,2-Benzothiazol-3-One | 197.01 | -0.9577 | 1.79 | 0.826 | 4 | 0 | 62.83 | 1 | 2 | 13 | 0 |
TCMC801 | C29H50O | Beta-Sitosterol | 414.39 | 1.3 | 4.54 | 11.595 | 1 | 1 | 20.23 | 13 | 4 | 30 | 1 |
TCMC995 | C35H60O6 | Daucosterol | 576.44 | -0.4469 | 4.65 | 10.487 | 6 | 4 | 99.38 | 19 | 5 | 41 | 1 |
TCMC1582 | C8H8O3 | Methylparaben | 152.05 | -0.4491 | 2.01 | 1.391 | 2 | 1 | 46.53 | 4 | 1 | 11 | 0 |
TCMC2111 | C4H6O4 | Succinic Acid | 118.03 | -0.41 | 1.46 | -0.71 | 4 | 2 | 74.6 | 5 | 0 | 8 | 0 |
TCMC2513 | C10H16N2O2 | Cyclo(L-Val-D-Pro) | 196.12 | -1.0221 | 2.12 | 0.456 | 4 | 1 | 52.9 | 4 | 2 | 14 | 0 |
TCMC2540 | C10H16N2O2 | Cyclo(L-Val-L-Pro) | 196.12 | -1.0221 | 2.12 | 0.456 | 4 | 1 | 52.9 | 4 | 2 | 14 | 0 |
TCMC3391 | C30H46O5 | Quillaic Acid | 485.3266995 | 0.0445 | 4.21 | 6.523 | 5 | 2 | 97.66 | 2 | 5 | 35 | 1 |
TCMC4142 | C6H10N2O2 | Cyclo-(Ala-Ala) | 142.0742276 | -1.4812 | 1.68 | 0.254 | 4 | 2 | 58.2 | 0 | 1 | 10 | 0 |
TCMC4927 | C8H12N2O2 | Cyclo-(Ala-Pro) | 168.0898776 | -2.0969 | 1.9 | 0.05 | 4 | 1 | 49.41 | 0 | 2 | 12 | 0 |
TCMC5449 | C42H64O15 | 3-O-Β-D-Galactopyranosyl-(1→2)-Β-D-Glucuronopyranosyl-Gypsogenin | 806.4088713 | -3.4518 | 4.43 | 4.148 | 15 | 6 | 255.63 | 8 | 7 | 57 | 2 |
TCMC6583 | C8H14N2O2 | Cyclo-(Ala-Val) | 170.1055277 | -0.9596 | 1.9 | 0.909 | 4 | 2 | 58.2 | 1 | 1 | 12 | 0 |