Description of the Component
Component ID |
TCMH1292 |
Latin Name |
Radix smilacis |
English Name |
root and rhizome of smilax |
Chinese Pinyin Name |
Ling Xian |
中文名 |
çµä»™ |
TCM Properties |
Warm,Pungent,Salty |
TCM Meridians |
Bladder |
Therapeutic Class English |
For dispelling wind-dampness |
Therapeutic Class Chinese |
祛风湿 |
Functions |
relieve rheumatic conditions, remove obstruction of collaterals, and alleviate pain |
Toxicity |
NA |
Geo-authentic habitats (道地产区) |
NA |
Reference |
Chinese Pharmacopoeia (2015) |
Barcode ID |
|
Barcode Source |
Targeted Human Proteins by the Ingredient of Component
| Target ID | Gene Symbol | Target Name | Target Class | Uniprot ID |
|---|---|---|---|---|
| TCMT150 | RORC | Nuclear receptor ROR-gamma | Nuclear receptor | P51449 |
| TCMT162 | UGT1A1 | UDP-glucuronosyltransferase 1-1 | Transferase | P22309 |
| TCMT3 | ALOX15 | Arachidonate 15-lipoxygenase | Oxidoreductase | P16050 |
| TCMT33 | CYP3A4 | Cytochrome P450 3A4 | Oxidoreductase | P08684 |
| TCMT63 | PPARA | Peroxisome proliferator-activated receptor alpha | Nuclear receptor | Q07869 |
| TCMT64 | PPARD | Peroxisome proliferator-activated receptor delta | Nuclear receptor | Q03181 |
| TCMT67 | PPARG | Peroxisome proliferator-activated receptor gamma | Nuclear receptor | P37231 |
| TCMT8 | KDM4E | Lysine-specific demethylase 4D-like | Oxidoreductase | B2RXH2 |
Targeted Pathogenic Microbes by the Ingredient of Component
| Target ID | Target Name |
|---|---|
| TCMT1178 | Actinomyces viscosus |
| TCMT1209 | Staphylococcus haemolyticus |
| TCMT1210 | Streptococcus sobrinus |
| TCMT1211 | Fusobacterium nucleatum |
| TCMT1218 | Staphylococcus aureus |
| TCMT1223 | Staphylococcus epidermidis |
| TCMT1226 | Klebsiella pneumoniae |
| TCMT1229 | Enterococcus faecalis |
| TCMT1245 | Phytophthora cactorum |
| TCMT1246 | Escherichia coli |
| TCMT1251 | Candida albicans |
| TCMT1253 | Penicillium chrysogenum |
| TCMT1321 | Staphylococcus hominis |
| TCMT1343 | Staphylococcus simulans |
| TCMT1344 | Staphylococcus sciuri |
| TCMT1370 | Prevotella melaninogenica |
| TCMT1408 | Colletotrichum gloeosporioides |
| TCMT1448 | Enterobacter aerogenes |
| TCMT1454 | Bacillus subtilis |
| TCMT1462 | Streptococcus mutans |
Ingredient Structrues
Ingredient ID: TCMC999
Formula: C10H20O2
Ingredient ID: TCMC999
| Common Name | Decanoic Acid |
| IUPAC Name | decanoic acid |
| Canonical SMILES | CCCCCCCCCC(=O)O |
| Standard InCHI | InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12) |
| Standard InCHIKey | GHVNFZFCNZKVNT-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL107498]; PubChem [2969]; |
| Reference of Component-Ingredient Pair | 29968805 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH307 | Cnidium officinale | Chuan Xiong Jin Gao | å·èŠŽæµ¸è† |
| TCMH1343 | Aloe vera | Lu Hui | èŠ¦èŸ |
| TCMH1469 | Flos mume | Mei Hua | 梅花 |
| TCMH827 | Terminalia chebula | He Zi Rou | 诃å肉 |
| TCMH422 | Angelica sinensis | Dang Gui Gan Jin Gao | å½“å½’å¹²æµ¸è† |
| TCMH1839 | Panax ginseng | Shan Shen | å±±å‚ |
| TCMH95 | Aquilaria sinensis | Bai Mu Xiang | 白木香 |
| TCMH1966 | Rehmannia glutinosa | Shu Di Huang | 熟地黄 |
| TCMH710 | Trichosanthes kirilowii maxim | Gua Lou Zi | 瓜蒌å |
| TCMH1531 | Akebia quinata | Mu Tong | 木通 |
| TCMH148 | Glehnia littoralis | Bei Sha Shen Liu Jin Gao | 北沙å‚æµæµ¸è† |
| TCMH114 | Platycladus orientalis | Bai Ye | æŸå¶ |
| TCMH1184 | Citrus reticulata | Ju Pi | 橘皮 |
| TCMH1714 | Lonicera japonica | Ren Dong Teng | å¿å†¬è—¤ |
| TCMH1846 | Artemisia capillaris | Shan Yin Chen | 山茵陈 |
| TCMH1127 | Lonicera japonica | Jin Yin Hua | 金银花 |
| TCMH1128 | Lonicera japonica | Jin Yin Hua Ti Qu Ye | 金银花æå–液 |
| TCMH421 | Angelica sinensis | Dang Gui | 当归 |
| TCMH1292 | Radix smilacis | Ling Xian | çµä»™ |
| TCMH1734 | Homo sapiens | Ren Zhong Bai | 人ä¸ç™½ |
| TCMH705 | Trichosanthes kirilowii | Gua Lou | 瓜蒌 |
| TCMH706 | Trichosanthes kirilowii | Gua Lou Pi | 瓜蒌皮 |
| TCMH707 | Trichosanthes kirilowii | Gua Lou Ren | ç“œè’Œä» |
| TCMH708 | Trichosanthes kirilowii | Gua Lou Ren Shuang | 瓜蒌ä»éœœ |
| TCMH709 | Trichosanthes kirilowii | Gua Lou Shi | æ 蒌实 |
| TCMH711 | Trichosanthes kirilowii | Gua Lou Gen | æ æ¥¼æ ¹ |
| TCMH712 | Trichosanthes kirilowii | Gua Lou Ren(1) | æ æ¥¼ä» |
| TCMH1178 | Citrus reticulata | Ju He | æ©˜æ ¸ |
| TCMH210 | Terminalia chebula | Cang Qing Guo | è—é’æžœ |
| TCMH826 | Terminalia chebula | He Zi | 诃å |
| TCMH93 | Prunus mume | Bai Mei Hua | 白梅花 |
| TCMH557 | Aster tataricus | Fan Hun Cao | è¿”é‚è‰ |
| TCMH939 | Aster tataricus | Huai Hun Cao | 还é‚è‰ |
| TCMH1490 | Aster tataricus | Mi Zi Wan | èœœç´«è€ |
| TCMH1721 | Panax ginseng | Ren Shen | äººå‚ |
| TCMH1728 | Panax ginseng | Ren Shen Ye | 人å‚å¶ |
| TCMH60 | Ginkgo biloba | Bai Guo | 白果 |
| TCMH61 | Ginkgo biloba | Bai Guo Ren | ç™½æžœä» |
| TCMH305 | Cnidium officinale | Chuan Xiong | å·èŠŽ |
| TCMH253 | Citrus aurantium | Cheng Pi | 橙皮 |
| TCMH8 | Rehmannia glutinosa | Ai Di Huang | 矮地黄 |
| TCMH451 | Rehmannia glutinosa | Di Huang | 地黄 |
| TCMH453 | Rehmannia glutinosa | Di Huang Tan | åœ°é»„ç‚ |
| TCMH643 | Rehmannia glutinosa | Gan Di Huang | 干地黄 |
| TCMH147 | Glehnia littoralis | Bei Sha Shen | åŒ—æ²™å‚ |
| TCMH2630 | Citrus aurantium | Zhi Shi | 枳实 |
| TCMH2506 | Ginkgo biloba | Yin Xing Ye | 银æå¶ |
| TCMH2166 | Clematis chinensis | Wei Ling Xian | å¨çµä»™ |
| TCMH2495 | Artemisia capillaris | Yin Chen Hao Gan Jin Gao | èŒµé™ˆè’¿å¹²æµ¸è† |
| TCMH2706 | Lithospermum erythrorhizon | Zi Cao | ç´«è‰ |
| TCMH2710 | Homo sapiens | Zi He Che | 紫河车 |
| TCMH2112 | Radix smilacis | Tie Si Wei Ling Xian | é“ä¸å¨çµä»™ |
| TCMH2728 | Aster tataricus | Zi Wan | ç´«è€ |
| TCMH2192 | Prunus mume | Wu Mei Rou | 乌梅肉 |
| TCMH2545 | Houttuynia cordata | Yu Xing Cao | é±¼è…¥è‰ |
| TCMH2086 | Trichosanthes kirilowii | Tian Hua Fen | 天花粉 |
| TCMH2573 | Ziziphus jujuba var. spinosa | Zao Ren | æž£ä» |
| TCMH2452 | Chrysanthemum indicum | Ye Ju Hua | 野èŠèŠ± |
| TCMH2315 | Arnebia euchroma | Xin Jiang Zi Cao | æ–°ç–†ç´«è‰ |
| TCMH2154 | Artemisia capillaris | Tu Yin Chen Hao | 土茵陈蒿 |
| TCMH2494 | Artemisia capillaris | Yin Chen Hao | 茵陈蒿 |
| TCMH2191 | Prunus mume | Wu Mei | 乌梅 |
| TCMH2051 | Ziziphus jujuba var. spinosa | Suan Zao | 酸枣 |
| TCMH2052 | Ziziphus jujuba var. spinosa | Suan Zao Ren | é…¸æž£ä» |
| TCMH2164 | Clematis chinensis | Wei Ling | å¨çµ |
| TCMH2613 | Citrus aurantium | Zhi Geng | 枳梗 |
| TCMH2618 | Citrus aurantium | Zhi Ke | 枳壳 |
| TCMH2619 | Citrus aurantium | Zhi Ke Gan Jin Gao | æž³å£³å¹²æµ¸è† |
Ingredient ID: TCMC696
Formula: C10H12O
Ingredient ID: TCMC696
| Common Name | Anethole |
| IUPAC Name | 1-methoxy-4-[(E)-prop-1-enyl]benzene |
| Canonical SMILES | C/C=C/c1ccc(cc1)OC |
| Standard InCHI | InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3+ |
| Standard InCHIKey | RUVINXPYWBROJD-ONEGZZNKSA-N |
| External Identifiers | ChEMBL [CHEMBL452630]; PubChem [637563]; |
| Reference of Component-Ingredient Pair | 29191726 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1862 | Cornus officinalis | Shan Zhu Yu | å±±èŒ±è¸ |
| TCMH924 | Zanthoxylum bungeanum | Hua Jiao | 花椒 |
| TCMH695 | Uncaria rhynchophylla | Gou Teng | é’©è—¤ |
| TCMH1835 | Kaempferia galanga | Shan Nai | 山柰 |
| TCMH143 | Albizia julibrissin | Bei He Huan | 北åˆæ¬¢ |
| TCMH1374 | Ocimum basilicum | Luo Le | ç½—å‹’ |
| TCMH685 | Syzygium aromaticum | Gong Ding Xiang | å…¬ä¸é¦™ |
| TCMH661 | Euphorbia kansui | Gan Sui | ç”˜é‚ |
| TCMH1000 | Foeniculum vulgare | Hui Xiang | 茴香 |
| TCMH1531 | Akebia quinata | Mu Tong | 木通 |
| TCMH132 | Scutellaria barbata | Ban Zhi Lian | åŠæžèŽ² |
| TCMH114 | Platycladus orientalis | Bai Ye | æŸå¶ |
| TCMH1175 | Cornus officinalis | Jiu Yu Rou | é…’è¸è‚‰ |
| TCMH1292 | Radix smilacis | Ling Xian | çµä»™ |
| TCMH1734 | Homo sapiens | Ren Zhong Bai | 人ä¸ç™½ |
| TCMH1158 | Ocimum basilicum | Jiu Ceng Ta | ä¹å±‚å¡” |
| TCMH1290 | Ocimum basilicum | Ling Ling Xiang | 零陵香 |
| TCMH557 | Aster tataricus | Fan Hun Cao | è¿”é‚è‰ |
| TCMH939 | Aster tataricus | Huai Hun Cao | 还é‚è‰ |
| TCMH1490 | Aster tataricus | Mi Zi Wan | èœœç´«è€ |
| TCMH519 | Pogostemon cablin | Du Huo Xiang | æœè—¿é¦™ |
| TCMH728 | Pogostemon cablin | Guang Huo Xiang | 广藿香 |
| TCMH1008 | Pogostemon cablin | Huo Xiang | 藿香 |
| TCMH1009 | Pogostemon cablin | Huo Xiang Ye | è—¿é¦™å¶ |
| TCMH60 | Ginkgo biloba | Bai Guo | 白果 |
| TCMH61 | Ginkgo biloba | Bai Guo Ren | ç™½æžœä» |
| TCMH486 | Syzygium aromaticum | Ding Xiang | ä¸é¦™ |
| TCMH628 | Glycyrrhiza uralensis | Gan Cao | ç”˜è‰ |
| TCMH629 | Glycyrrhiza uralensis | Gan Cao Fen | 甘è‰ç²‰ |
| TCMH630 | Glycyrrhiza uralensis | Gan Cao Gan Gao | 甘è‰å¹²è† |
| TCMH631 | Glycyrrhiza uralensis | Gan Cao Gan Gao Fen | 甘è‰å¹²è†ç²‰ |
| TCMH632 | Glycyrrhiza uralensis | Gan Cao Gan Jin Gao | 甘è‰å¹²æµ¸è† |
| TCMH633 | Glycyrrhiza uralensis | Gan Cao Gao | 甘è‰è† |
| TCMH634 | Glycyrrhiza uralensis | Gan Cao Jie | 甘è‰èŠ‚ |
| TCMH635 | Glycyrrhiza uralensis | Gan Cao Jin Gao | 甘è‰æµ¸è† |
| TCMH636 | Glycyrrhiza uralensis | Gan Cao Liu Jin Gao | 甘è‰æµæµ¸è† |
| TCMH1475 | Glycyrrhiza uralensis | Mi Gan Cao | èœœç”˜è‰ |
| TCMH1899 | Glycyrrhiza uralensis | Sheng Gan Cao | ç”Ÿç”˜è‰ |
| TCMH2506 | Ginkgo biloba | Yin Xing Ye | 银æå¶ |
| TCMH2166 | Clematis chinensis | Wei Ling Xian | å¨çµä»™ |
| TCMH2137 | Pogostemon cablin | Tu Huo Xiang | 土藿香 |
| TCMH2706 | Lithospermum erythrorhizon | Zi Cao | ç´«è‰ |
| TCMH2710 | Homo sapiens | Zi He Che | 紫河车 |
| TCMH2112 | Radix smilacis | Tie Si Wei Ling Xian | é“ä¸å¨çµä»™ |
| TCMH2728 | Aster tataricus | Zi Wan | ç´«è€ |
| TCMH2135 | Glycyrrhiza uralensis | Tu Gan Cao | åœŸç”˜è‰ |
| TCMH2315 | Arnebia euchroma | Xin Jiang Zi Cao | æ–°ç–†ç´«è‰ |
| TCMH2164 | Clematis chinensis | Wei Ling | å¨çµ |
Ingredient ID: TCMC463
Formula: C14H12N2S
Ingredient ID: TCMC463
| Common Name | 4-(1,3-Benzothiazol-2-Yl)-2-Methylaniline |
| IUPAC Name | 4-(1,3-benzothiazol-2-yl)-2-methylaniline |
| Canonical SMILES | Nc1ccc(cc1C)c1nc2c(s1)cccc2 |
| Standard InCHI | InChI=1S/C14H12N2S/c1-9-8-10(6-7-11(9)15)14-16-12-4-2-3-5-13(12)17-14/h2-8H,15H2,1H3 |
| Standard InCHIKey | IDBCUMFOZBUJCL-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL11825]; PubChem [384525]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1939 | Combretum indicum | Shi Jun Zi Ren | 使å›åä» |
| TCMH865 | Carthamus tinctorius | Hong Hua | 红花 |
| TCMH1292 | Radix smilacis | Ling Xian | çµä»™ |
| TCMH1810 | Semen astragali complanati | Sha Yuan Ji Li | 沙苑蒺藜 |
| TCMH1811 | Semen astragali complanati | Sha Yuan Zi | 沙苑å |
| TCMH2166 | Clematis chinensis | Wei Ling Xian | å¨çµä»™ |
| TCMH2112 | Radix smilacis | Tie Si Wei Ling Xian | é“ä¸å¨çµä»™ |
| TCMH2121 | Semen astragali complanati | Tong Ji Li | 潼蒺藜 |
| TCMH2164 | Clematis chinensis | Wei Ling | å¨çµ |
Ingredient ID: TCMC2541
Formula: C10H18O
Ingredient ID: TCMC2541
| Common Name | Alpha-Terpineol |
| IUPAC Name | 2-[(1S)-4-methylcyclohex-3-en-1-yl]propan-2-ol |
| Canonical SMILES | CC1=CC[C@H](CC1)C(O)(C)C |
| Standard InCHI | InChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h4,9,11H,5-7H2,1-3H3/t9-/m1/s1 |
| Standard InCHIKey | WUOACPNHFRMFPN-SECBINFHSA-N |
| External Identifiers | ChEMBL [CHEMBL447597]; PubChem [443162]; |
| Reference of Component-Ingredient Pair | 27231091 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1862 | Cornus officinalis | Shan Zhu Yu | å±±èŒ±è¸ |
| TCMH907 | Piper nigrum | Hu Jiao | 胡椒 |
| TCMH1063 | Curcuma longa | Jiang Huang | 姜黄 |
| TCMH924 | Zanthoxylum bungeanum | Hua Jiao | 花椒 |
| TCMH265 | Laggera pterodonta | Chu Ling Dan Cao | è‡çµä¸¹è‰ |
| TCMH1753 | Boswellia carterii | Ru Xiang | 乳香 |
| TCMH1348 | Liquidambar formosana | Lu Lu Tong | 路路通 |
| TCMH1693 | Aristolochia debilis | Qing Mu Xiang | é’木香 |
| TCMH1165 | Murraya paniculata | Jiu Li Xiang | ä¹é‡Œé¦™ |
| TCMH307 | Cnidium officinale | Chuan Xiong Jin Gao | å·èŠŽæµ¸è† |
| TCMH1923 | Acorus tatarinowii | Shi Chang Pu Qing Gao | 石è–è’²æ¸…è† |
| TCMH1825 | Litsea cubeba | Shan Jiang Zi | 山姜å |
| TCMH1609 | Eupatorium fortunei | Pei Lan | 佩兰 |
| TCMH1894 | Pinellia ternata | Sheng Ban Xia | 生åŠå¤ |
| TCMH1979 | Flos lonicerae | Shuang Hua | åŒèŠ± |
| TCMH108 | Perilla frutescens | Bai Su Zi | 白è‹å |
| TCMH526 | Eucommia ulmoides | Du Zhong Ye | æœä»²å¶ |
| TCMH422 | Angelica sinensis | Dang Gui Gan Jin Gao | å½“å½’å¹²æµ¸è† |
| TCMH1432 | Vitex trifolia | Man Jing Zi | 蔓è†å |
| TCMH243 | Pericarpium citri reticulatae | Chen Pi | 陈皮 |
| TCMH685 | Syzygium aromaticum | Gong Ding Xiang | å…¬ä¸é¦™ |
| TCMH1601 | Nelumbo nucifera | Ou Pian | 藕片 |
| TCMH670 | Ligusticum sinense | Gao Ben | è—本 |
| TCMH1033 | Centella asiatica | Ji Xue Cao | ç§¯é›ªè‰ |
| TCMH1486 | Ephedra sinica | Mi Ma Huang | 蜜麻黄 |
| TCMH970 | Vitex negundo | Huang Jing Zi | 黄è†å |
| TCMH223 | Platycladus orientalis | Ce Bai Tan | 侧æŸç‚ |
| TCMH1903 | Zingiber officinale | Sheng Jiang | 生姜 |
| TCMH447 | Illicium difengpi | Di Feng Pi | 地枫皮 |
| TCMH1181 | Chrysanthemum morifolium | Ju Hua | èŠèŠ± |
| TCMH1531 | Akebia quinata | Mu Tong | 木通 |
| TCMH148 | Glehnia littoralis | Bei Sha Shen Liu Jin Gao | 北沙å‚æµæµ¸è† |
| TCMH348 | Lobelia chinensis | Da Ban Bian Lian | 大åŠè¾¹èŽ² |
| TCMH1272 | Forsythia suspensa | Lian Qiao | 连翘 |
| TCMH160 | Piper cubeba | Bi Cheng Qie | 毕澄茄 |
| TCMH132 | Scutellaria barbata | Ban Zhi Lian | åŠæžèŽ² |
| TCMH114 | Platycladus orientalis | Bai Ye | æŸå¶ |
| TCMH1219 | Semen armeniacae amarum | Ku Xing Ren | 苦æä» |
| TCMH1970 | Pericarpium zanthoxyli | Shu Jiao | 蜀椒 |
| TCMH203 | Acorus calamus | Cang Chang Pu | è—è–è’² |
| TCMH1741 | Myristica fragrans | Rou Dou Kou | 肉豆蔻 |
| TCMH1804 | Amomum villosum | Sha Ren Ye | ç ‚ä»å¶ |
| TCMH1184 | Citrus reticulata | Ju Pi | 橘皮 |
| TCMH1686 | Canarium album | Qing Guo Tan | é’æžœç‚ |
| TCMH1714 | Lonicera japonica | Ren Dong Teng | å¿å†¬è—¤ |
| TCMH13 | Artemisia argyi | Ai Ye You | 艾å¶æ²¹ |
| TCMH1846 | Artemisia capillaris | Shan Yin Chen | 山茵陈 |
| TCMH1803 | Amomum villosum | Sha Ren | ç ‚ä» |
| TCMH737 | Crataegus pinnatifida | Guang Shan Zha | 广山楂 |
| TCMH1848 | Crataegus pinnatifida | Shan Zha | 山楂 |
| TCMH1849 | Crataegus pinnatifida | Shan Zha Chou Gao | å±±æ¥‚ç¨ è† |
| TCMH1852 | Crataegus pinnatifida | Shan Zha Qing Gao | å±±æ¥‚æ¸…è† |
| TCMH1853 | Crataegus pinnatifida | Shan Zha Tan | å±±æ¥‚ç‚ |
| TCMH1175 | Cornus officinalis | Jiu Yu Rou | é…’è¸è‚‰ |
| TCMH122 | Lobelia chinensis | Ban Bian Lian | åŠè¾¹èŽ² |
| TCMH1127 | Lonicera japonica | Jin Yin Hua | 金银花 |
| TCMH1128 | Lonicera japonica | Jin Yin Hua Ti Qu Ye | 金银花æå–液 |
| TCMH421 | Angelica sinensis | Dang Gui | 当归 |
| TCMH1292 | Radix smilacis | Ling Xian | çµä»™ |
| TCMH524 | Eucommia ulmoides | Du Zhong | æœä»² |
| TCMH525 | Eucommia ulmoides | Du Zhong Tan | æœä»²ç‚ |
| TCMH592 | Liquidambar formosana | Feng Xiang Ye | æž«é¦™å¶ |
| TCMH594 | Liquidambar formosana | Feng Xiang Zhi Chou Gao | æž«é¦™è„‚ç¨ è† |
| TCMH1398 | Ephedra sinica | Ma Huang | 麻黄 |
| TCMH1399 | Ephedra sinica | Ma Huang Gao | éº»é»„è† |
| TCMH1400 | Ephedra sinica | Ma Huang Gen | éº»é»„æ ¹ |
| TCMH1401 | Ephedra sinica | Ma Huang Jin Gao | éº»é»„æµ¸è† |
| TCMH130 | Pinellia ternata | Ban Xia | åŠå¤ |
| TCMH131 | Pinellia ternata | Ban Xia Qu | åŠå¤æ›² |
| TCMH1677 | Pinellia ternata | Qing Ban Xia | 清åŠå¤ |
| TCMH1215 | Sophora flavescens | Ku Shen | è‹¦å‚ |
| TCMH1943 | Punica granatum | Shi Liu | 石榴 |
| TCMH1944 | Punica granatum | Shi Liu Pi | 石榴皮 |
| TCMH1945 | Punica granatum | Shi Liu Zi | 石榴å |
| TCMH1431 | Vitex trifolia | Man Jing Ye | 蔓è†å¶ |
| TCMH309 | Curcuma longa | Chuan Yu Jin | å·éƒé‡‘ |
| TCMH1397 | Aristolochia debilis | Ma Dou Ling | 马兜铃 |
| TCMH1178 | Citrus reticulata | Ju He | æ©˜æ ¸ |
| TCMH12 | Artemisia argyi | Ai Ye | è‰¾å¶ |
| TCMH264 | Laggera pterodonta | Chu Ling Dan | è‡çµä¸¹ |
| TCMH64 | Piper nigrum | Bai Hu Jiao | 白胡椒 |
| TCMH839 | Piper nigrum | Hei Hu Jiao | 黑胡椒 |
| TCMH511 | Litsea cubeba | Dou Chi Jiang | 豆豉姜 |
| TCMH1812 | Litsea cubeba | Shan Cang Zi | å±±è‹å |
| TCMH60 | Ginkgo biloba | Bai Guo | 白果 |
| TCMH61 | Ginkgo biloba | Bai Guo Ren | ç™½æžœä» |
| TCMH809 | Chrysanthemum morifolium | Hang Ju | æèŠ |
| TCMH305 | Cnidium officinale | Chuan Xiong | å·èŠŽ |
| TCMH814 | Nelumbo nucifera | He Geng | è·æ¢— |
| TCMH825 | Nelumbo nucifera | He Ye | è·å¶ |
| TCMH1275 | Nelumbo nucifera | Lian Zi | 莲å |
| TCMH1276 | Nelumbo nucifera | Lian Zi Xin | 莲å心 |
| TCMH1598 | Nelumbo nucifera | Ou | è—• |
| TCMH1599 | Nelumbo nucifera | Ou Fen | 藕粉 |
| TCMH486 | Syzygium aromaticum | Ding Xiang | ä¸é¦™ |
| TCMH650 | Canarium album | Gan Lan | 橄榄 |
| TCMH1683 | Canarium album | Qing Guo | é’æžœ |
| TCMH283 | Coptis chinensis | Chuan Huang Lian | å·é»„è¿ž |
| TCMH972 | Coptis chinensis | Huang Lian | 黄连 |
| TCMH973 | Coptis chinensis | Huang Lian Gan Jin Gao | é»„è¿žå¹²æµ¸è† |
| 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 |
| TCMH253 | Citrus aurantium | Cheng Pi | 橙皮 |
| TCMH1920 | Acorus tatarinowii | Shi Chang Pu | 石è–è’² |
| TCMH1922 | Acorus tatarinowii | Shi Chang Pu Jin Gao | 石è–è’²æµ¸è† |
| TCMH147 | Glehnia littoralis | Bei Sha Shen | åŒ—æ²™å‚ |
| TCMH2039 | Caulis perillae frutescentis | Su Geng | è‹æ¢— |
| TCMH2630 | Citrus aurantium | Zhi Shi | 枳实 |
| TCMH2580 | Coptis chinensis | Ze Xi Huang Lian | 择细黄连 |
| TCMH2506 | Ginkgo biloba | Yin Xing Ye | 银æå¶ |
| TCMH2166 | Clematis chinensis | Wei Ling Xian | å¨çµä»™ |
| TCMH2495 | Artemisia capillaris | Yin Chen Hao Gan Jin Gao | èŒµé™ˆè’¿å¹²æµ¸è† |
| TCMH2143 | Sophora flavescens | Tu Ku Shen | åœŸè‹¦å‚ |
| TCMH2144 | Inula helenium | Tu Mu Xiang | 土木香 |
| TCMH2265 | Cyperus rotundus | Xiang Fu | 香附 |
| TCMH2050 | Punica granatum | Suan Shi Liu | 酸石榴 |
| TCMH2462 | Crataegus pinnatifida | Ye Shan Zha | 野山楂 |
| TCMH2112 | Radix smilacis | Tie Si Wei Ling Xian | é“ä¸å¨çµä»™ |
| TCMH2239 | Asarum sieboldii | Xi Xin | 细辛 |
| TCMH2651 | Elsholtzia splendens | Zhou Ye Xiang Ru | çš±å¶é¦™è–· |
| TCMH2545 | Houttuynia cordata | Yu Xing Cao | é±¼è…¥è‰ |
| TCMH2452 | Chrysanthemum indicum | Ye Ju Hua | 野èŠèŠ± |
| TCMH2101 | Eupatorium rebaudianum | Tian Ye Ju | 甜å¶èŠ |
| TCMH2320 | Magnolia liliflora | Xin Yi Ren | è¾›å¤·ä» |
| TCMH2055 | Fructus amomi | Suo Sha Ren | ç¼©ç ‚ä» |
| TCMH2267 | Periploca sepium | Xiang Jia Pi | é¦™åŠ çš® |
| TCMH2282 | Citrus medica | Xiang Yuan Pi | 香橼皮 |
| TCMH2211 | Artemisia princeps | Wu Yue Ai | 五月艾 |
| TCMH2154 | Artemisia capillaris | Tu Yin Chen Hao | 土茵陈蒿 |
| TCMH2494 | Artemisia capillaris | Yin Chen Hao | 茵陈蒿 |
| TCMH2281 | Citrus medica | Xiang Yuan | 香橼 |
| TCMH2080 | Sophora flavescens | Teng Ku Shen | è—¤è‹¦å‚ |
| TCMH2276 | Elsholtzia splendens | Xiang Ru | 香薷 |
| TCMH2316 | Magnolia liliflora | Xin Yi | 辛夷 |
| TCMH2317 | Magnolia liliflora | Xin Yi Hua | 辛夷花 |
| TCMH2319 | Magnolia liliflora | Xin Yi Hua Jin Gao Fen | 辛夷花浸è†ç²‰ |
| TCMH2330 | Coptis chinensis | Xiong Huang Lian | 雄黄连 |
| TCMH2531 | Coptis chinensis | Yu Huang Lian | è¸é»„è¿ž |
| TCMH2164 | Clematis chinensis | Wei Ling | å¨çµ |
| TCMH2613 | Citrus aurantium | Zhi Geng | 枳梗 |
| TCMH2618 | Citrus aurantium | Zhi Ke | 枳壳 |
| TCMH2619 | Citrus aurantium | Zhi Ke Gan Jin Gao | æž³å£³å¹²æµ¸è† |
Ingredient ID: TCMC2166
Formula: C10H14O
Ingredient ID: TCMC2166
| Common Name | Thymol |
| IUPAC Name | 5-methyl-2-propan-2-ylphenol |
| Canonical SMILES | Cc1ccc(c(c1)O)C(C)C |
| Standard InCHI | InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3 |
| Standard InCHIKey | MGSRCZKZVOBKFT-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL29411]; PubChem [6989]; |
| Reference of Component-Ingredient Pair | 29191726 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH211 | Atractylodes lancea | Cang Zhu | è‹æœ¯ |
| TCMH1165 | Murraya paniculata | Jiu Li Xiang | ä¹é‡Œé¦™ |
| TCMH491 | Oleum ocimi gratissimi | Ding Xiang Luo Le You | ä¸é¦™ç½—å‹’æ²¹ |
| TCMH307 | Cnidium officinale | Chuan Xiong Jin Gao | å·èŠŽæµ¸è† |
| TCMH1380 | Humulus japonicus | Lv Cao | è‘Žè‰ |
| TCMH1923 | Acorus tatarinowii | Shi Chang Pu Qing Gao | 石è–è’²æ¸…è† |
| TCMH1609 | Eupatorium fortunei | Pei Lan | 佩兰 |
| TCMH517 | Angelica pubescens | Du Huo | 独活 |
| TCMH108 | Perilla frutescens | Bai Su Zi | 白è‹å |
| TCMH243 | Pericarpium citri reticulatae | Chen Pi | 陈皮 |
| TCMH685 | Syzygium aromaticum | Gong Ding Xiang | å…¬ä¸é¦™ |
| TCMH670 | Ligusticum sinense | Gao Ben | è—本 |
| TCMH1486 | Ephedra sinica | Mi Ma Huang | 蜜麻黄 |
| TCMH1903 | Zingiber officinale | Sheng Jiang | 生姜 |
| TCMH1592 | Origanum vulgare | Niu Zhi | 牛至 |
| TCMH1181 | Chrysanthemum morifolium | Ju Hua | èŠèŠ± |
| TCMH71 | Oldenlandia diffusa | Bai Hua She She Cao | ç™½èŠ±è›‡èˆŒè‰ |
| TCMH132 | Scutellaria barbata | Ban Zhi Lian | åŠæžèŽ² |
| TCMH114 | Platycladus orientalis | Bai Ye | æŸå¶ |
| TCMH1029 | Paederia scandens | Ji Shi Teng | 鸡矢藤 |
| TCMH1184 | Citrus reticulata | Ju Pi | 橘皮 |
| TCMH1846 | Artemisia capillaris | Shan Yin Chen | 山茵陈 |
| TCMH1292 | Radix smilacis | Ling Xian | çµä»™ |
| TCMH1734 | Homo sapiens | Ren Zhong Bai | 人ä¸ç™½ |
| TCMH1398 | Ephedra sinica | Ma Huang | 麻黄 |
| TCMH1399 | Ephedra sinica | Ma Huang Gao | éº»é»„è† |
| TCMH1400 | Ephedra sinica | Ma Huang Gen | éº»é»„æ ¹ |
| TCMH1401 | Ephedra sinica | Ma Huang Jin Gao | éº»é»„æµ¸è† |
| TCMH279 | Angelica pubescens | Chuan Du Huo | å·ç‹¬æ´» |
| TCMH1178 | Citrus reticulata | Ju He | æ©˜æ ¸ |
| TCMH458 | Pericarpium citri reticulatae viride | Di Qing Pi | 地é’çš® |
| TCMH1695 | Pericarpium citri reticulatae viride | Qing Pi | é’çš® |
| TCMH228 | Bupleurum chinense | Chai Hu | 柴胡 |
| TCMH229 | Bupleurum chinense | Chai Hu Jin Gao | æŸ´èƒ¡æµ¸è† |
| TCMH230 | Bupleurum chinense | Chai Hu Shao | 柴胡梢 |
| TCMH60 | Ginkgo biloba | Bai Guo | 白果 |
| TCMH61 | Ginkgo biloba | Bai Guo Ren | ç™½æžœä» |
| TCMH809 | Chrysanthemum morifolium | Hang Ju | æèŠ |
| TCMH305 | Cnidium officinale | Chuan Xiong | å·èŠŽ |
| TCMH486 | Syzygium aromaticum | Ding Xiang | ä¸é¦™ |
| TCMH1920 | Acorus tatarinowii | Shi Chang Pu | 石è–è’² |
| TCMH1922 | Acorus tatarinowii | Shi Chang Pu Jin Gao | 石è–è’²æµ¸è† |
| TCMH2407 | Bupleurum chinense | Yan Tai Chai Hu | 烟å°æŸ´èƒ¡ |
| TCMH2506 | Ginkgo biloba | Yin Xing Ye | 银æå¶ |
| TCMH2166 | Clematis chinensis | Wei Ling Xian | å¨çµä»™ |
| TCMH2495 | Artemisia capillaris | Yin Chen Hao Gan Jin Gao | èŒµé™ˆè’¿å¹²æµ¸è† |
| TCMH2201 | Securidaca inappendiculata | Wu Wei Teng | 五味藤 |
| TCMH2303 | Pericarpium citri reticulatae viride | Xiao Qing Pi | å°é’çš® |
| TCMH2538 | Zea mays | Yu Mi Xu | 玉米须 |
| TCMH2077 | Prunus persica | Tao Zhi | æ¡ƒæž |
| TCMH2710 | Homo sapiens | Zi He Che | 紫河车 |
| TCMH2112 | Radix smilacis | Tie Si Wei Ling Xian | é“ä¸å¨çµä»™ |
| TCMH2239 | Asarum sieboldii | Xi Xin | 细辛 |
| TCMH2129 | Eupolyphaga sinensis | Tu Bie Chong | 土鳖虫 |
| TCMH2651 | Elsholtzia splendens | Zhou Ye Xiang Ru | çš±å¶é¦™è–· |
| TCMH2545 | Houttuynia cordata | Yu Xing Cao | é±¼è…¥è‰ |
| TCMH2452 | Chrysanthemum indicum | Ye Ju Hua | 野èŠèŠ± |
| TCMH2320 | Magnolia liliflora | Xin Yi Ren | è¾›å¤·ä» |
| TCMH2606 | Lysimachia clethroides | Zhen Zhu Cai | çç èœ |
| TCMH2154 | Artemisia capillaris | Tu Yin Chen Hao | 土茵陈蒿 |
| TCMH2494 | Artemisia capillaris | Yin Chen Hao | 茵陈蒿 |
| TCMH2071 | Prunus persica | Tao | 桃 |
| TCMH2073 | Prunus persica | Tao Ren | æ¡ƒä» |
| TCMH2074 | Prunus persica | Tao Ren Shuang | 桃ä»éœœ |
| TCMH2276 | Elsholtzia splendens | Xiang Ru | 香薷 |
| TCMH2316 | Magnolia liliflora | Xin Yi | 辛夷 |
| TCMH2317 | Magnolia liliflora | Xin Yi Hua | 辛夷花 |
| TCMH2319 | Magnolia liliflora | Xin Yi Hua Jin Gao Fen | 辛夷花浸è†ç²‰ |
| TCMH2164 | Clematis chinensis | Wei Ling | å¨çµ |
Ingredient ID: TCMC1777
Formula: C8H18O
Ingredient ID: TCMC1777
| Common Name | Octanol |
| IUPAC Name | octan-1-ol |
| Canonical SMILES | CCCCCCCCO |
| Standard InCHI | InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3 |
| Standard InCHIKey | KBPLFHHGFOOTCA-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL26215]; PubChem [957]; |
| Reference of Component-Ingredient Pair | 23084055 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1753 | Boswellia carterii | Ru Xiang | 乳香 |
| TCMH1186 | Lycium chinense | Gou Qi Zi | 枸æžå |
| TCMH317 | Capsella bursa-pastoris | Ci Cai | è èœ |
| TCMH1343 | Aloe vera | Lu Hui | èŠ¦èŸ |
| TCMH873 | Radix et rhizoma rhodiolae | Hong Jing Tian | 红景天 |
| TCMH1469 | Flos mume | Mei Hua | 梅花 |
| TCMH827 | Terminalia chebula | He Zi Rou | 诃å肉 |
| TCMH290 | Radix cudraniae | Chuan Po Shi | ç©¿ç ´çŸ³ |
| TCMH1299 | Ganoderma lucidum | Ling Zhi(1) | çµèŠ |
| TCMH1839 | Panax ginseng | Shan Shen | å±±å‚ |
| TCMH74 | Patrinia villosa | Bai Jiang | 败酱 |
| TCMH1486 | Ephedra sinica | Mi Ma Huang | 蜜麻黄 |
| TCMH1000 | Foeniculum vulgare | Hui Xiang | 茴香 |
| TCMH403 | Zanthoxylum echinocarpum | Dan Mian Zhen | å•é¢é’ˆ |
| TCMH148 | Glehnia littoralis | Bei Sha Shen Liu Jin Gao | 北沙å‚æµæµ¸è† |
| TCMH1184 | Citrus reticulata | Ju Pi | 橘皮 |
| TCMH892 | Hericium erinaceus | Hou Tou Jun | çŒ´å¤´èŒ |
| TCMH98 | Cynanchum stauntonii | Bai Qian | ç™½å‰ |
| TCMH1292 | Radix smilacis | Ling Xian | çµä»™ |
| TCMH1185 | Lycium chinense | Gou Qi | æž¸æž |
| TCMH1734 | Homo sapiens | Ren Zhong Bai | 人ä¸ç™½ |
| TCMH1398 | Ephedra sinica | Ma Huang | 麻黄 |
| TCMH1399 | Ephedra sinica | Ma Huang Gao | éº»é»„è† |
| TCMH1400 | Ephedra sinica | Ma Huang Gen | éº»é»„æ ¹ |
| TCMH1401 | Ephedra sinica | Ma Huang Jin Gao | éº»é»„æµ¸è† |
| TCMH1296 | Ganoderma lucidum | Ling Zhi Jin Gao | çµèŠæµ¸è† |
| TCMH1178 | Citrus reticulata | Ju He | æ©˜æ ¸ |
| TCMH210 | Terminalia chebula | Cang Qing Guo | è—é’æžœ |
| TCMH826 | Terminalia chebula | He Zi | 诃å |
| TCMH1721 | Panax ginseng | Ren Shen | äººå‚ |
| TCMH1728 | Panax ginseng | Ren Shen Ye | 人å‚å¶ |
| TCMH60 | Ginkgo biloba | Bai Guo | 白果 |
| TCMH61 | Ginkgo biloba | Bai Guo Ren | ç™½æžœä» |
| TCMH253 | Citrus aurantium | Cheng Pi | 橙皮 |
| TCMH147 | Glehnia littoralis | Bei Sha Shen | åŒ—æ²™å‚ |
| TCMH2630 | Citrus aurantium | Zhi Shi | 枳实 |
| TCMH2506 | Ginkgo biloba | Yin Xing Ye | 银æå¶ |
| TCMH2166 | Clematis chinensis | Wei Ling Xian | å¨çµä»™ |
| TCMH2201 | Securidaca inappendiculata | Wu Wei Teng | 五味藤 |
| TCMH2077 | Prunus persica | Tao Zhi | æ¡ƒæž |
| TCMH2710 | Homo sapiens | Zi He Che | 紫河车 |
| TCMH2241 | Panax quinquefolium | Xi Yang Shen | è¥¿æ´‹å‚ |
| TCMH2112 | Radix smilacis | Tie Si Wei Ling Xian | é“ä¸å¨çµä»™ |
| TCMH2129 | Eupolyphaga sinensis | Tu Bie Chong | 土鳖虫 |
| TCMH2071 | Prunus persica | Tao | 桃 |
| TCMH2073 | Prunus persica | Tao Ren | æ¡ƒä» |
| TCMH2074 | Prunus persica | Tao Ren Shuang | 桃ä»éœœ |
| TCMH2164 | Clematis chinensis | Wei Ling | å¨çµ |
| TCMH2613 | Citrus aurantium | Zhi Geng | 枳梗 |
| TCMH2618 | Citrus aurantium | Zhi Ke | 枳壳 |
| TCMH2619 | Citrus aurantium | Zhi Ke Gan Jin Gao | æž³å£³å¹²æµ¸è† |
Ingredient ID: TCMC1578
Formula: C11H14O2
Ingredient ID: TCMC1578
| Common Name | Methyleugenol |
| IUPAC Name | 1,2-dimethoxy-4-prop-2-enylbenzene |
| Canonical SMILES | C=CCc1ccc(c(c1)OC)OC |
| Standard InCHI | InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4,6-8H,1,5H2,2-3H3 |
| Standard InCHIKey | ZYEMGPIYFIJGTP-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL108861]; PubChem [7127]; |
| Reference of Component-Ingredient Pair | 28326452 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1862 | Cornus officinalis | Shan Zhu Yu | å±±èŒ±è¸ |
| TCMH924 | Zanthoxylum bungeanum | Hua Jiao | 花椒 |
| TCMH512 | Fructus amomi rotundus | Dou Kou | 豆蔻 |
| TCMH307 | Cnidium officinale | Chuan Xiong Jin Gao | å·èŠŽæµ¸è† |
| TCMH1374 | Ocimum basilicum | Luo Le | ç½—å‹’ |
| TCMH1923 | Acorus tatarinowii | Shi Chang Pu Qing Gao | 石è–è’²æ¸…è† |
| TCMH1894 | Pinellia ternata | Sheng Ban Xia | 生åŠå¤ |
| TCMH417 | Rhizoma arisaema cum bile | Dan Xing | 胆星 |
| TCMH860 | Fructus galangae | Hong Dou Kou | 红豆蔻 |
| TCMH422 | Angelica sinensis | Dang Gui Gan Jin Gao | å½“å½’å¹²æµ¸è† |
| TCMH1518 | Chaenomeles sinensis | Mu Gua | 木瓜 |
| TCMH670 | Ligusticum sinense | Gao Ben | è—本 |
| TCMH1903 | Zingiber officinale | Sheng Jiang | 生姜 |
| TCMH447 | Illicium difengpi | Di Feng Pi | 地枫皮 |
| TCMH1531 | Akebia quinata | Mu Tong | 木通 |
| TCMH148 | Glehnia littoralis | Bei Sha Shen Liu Jin Gao | 北沙å‚æµæµ¸è† |
| TCMH1466 | Rosa rugosa | Mei Gui Hua | 玫瑰花 |
| TCMH132 | Scutellaria barbata | Ban Zhi Lian | åŠæžèŽ² |
| TCMH1970 | Pericarpium zanthoxyli | Shu Jiao | 蜀椒 |
| TCMH203 | Acorus calamus | Cang Chang Pu | è—è–è’² |
| TCMH1741 | Myristica fragrans | Rou Dou Kou | 肉豆蔻 |
| TCMH892 | Hericium erinaceus | Hou Tou Jun | çŒ´å¤´èŒ |
| TCMH13 | Artemisia argyi | Ai Ye You | 艾å¶æ²¹ |
| TCMH1846 | Artemisia capillaris | Shan Yin Chen | 山茵陈 |
| TCMH1175 | Cornus officinalis | Jiu Yu Rou | é…’è¸è‚‰ |
| TCMH421 | Angelica sinensis | Dang Gui | 当归 |
| TCMH1292 | Radix smilacis | Ling Xian | çµä»™ |
| TCMH1734 | Homo sapiens | Ren Zhong Bai | 人ä¸ç™½ |
| TCMH130 | Pinellia ternata | Ban Xia | åŠå¤ |
| TCMH131 | Pinellia ternata | Ban Xia Qu | åŠå¤æ›² |
| TCMH1677 | Pinellia ternata | Qing Ban Xia | 清åŠå¤ |
| TCMH1215 | Sophora flavescens | Ku Shen | è‹¦å‚ |
| TCMH1158 | Ocimum basilicum | Jiu Ceng Ta | ä¹å±‚å¡” |
| TCMH1290 | Ocimum basilicum | Ling Ling Xiang | 零陵香 |
| TCMH404 | Rhizoma arisaema cum bile | Dan Nan Xing | 胆å—星 |
| TCMH12 | Artemisia argyi | Ai Ye | è‰¾å¶ |
| TCMH60 | Ginkgo biloba | Bai Guo | 白果 |
| TCMH61 | Ginkgo biloba | Bai Guo Ren | ç™½æžœä» |
| TCMH305 | Cnidium officinale | Chuan Xiong | å·èŠŽ |
| TCMH1920 | Acorus tatarinowii | Shi Chang Pu | 石è–è’² |
| TCMH1922 | Acorus tatarinowii | Shi Chang Pu Jin Gao | 石è–è’²æµ¸è† |
| TCMH147 | Glehnia littoralis | Bei Sha Shen | åŒ—æ²™å‚ |
| TCMH2039 | Caulis perillae frutescentis | Su Geng | è‹æ¢— |
| TCMH2506 | Ginkgo biloba | Yin Xing Ye | 银æå¶ |
| TCMH2166 | Clematis chinensis | Wei Ling Xian | å¨çµä»™ |
| TCMH2495 | Artemisia capillaris | Yin Chen Hao Gan Jin Gao | èŒµé™ˆè’¿å¹²æµ¸è† |
| TCMH2143 | Sophora flavescens | Tu Ku Shen | åœŸè‹¦å‚ |
| TCMH2556 | Polygala tenuifolia | Yuan Zhi Liu Jin Gao | 远志æµæµ¸è† |
| TCMH2706 | Lithospermum erythrorhizon | Zi Cao | ç´«è‰ |
| TCMH2710 | Homo sapiens | Zi He Che | 紫河车 |
| TCMH2112 | Radix smilacis | Tie Si Wei Ling Xian | é“ä¸å¨çµä»™ |
| TCMH2239 | Asarum sieboldii | Xi Xin | 细辛 |
| TCMH2651 | Elsholtzia splendens | Zhou Ye Xiang Ru | çš±å¶é¦™è–· |
| TCMH2320 | Magnolia liliflora | Xin Yi Ren | è¾›å¤·ä» |
| TCMH2055 | Fructus amomi | Suo Sha Ren | ç¼©ç ‚ä» |
| TCMH2315 | Arnebia euchroma | Xin Jiang Zi Cao | æ–°ç–†ç´«è‰ |
| TCMH2154 | Artemisia capillaris | Tu Yin Chen Hao | 土茵陈蒿 |
| TCMH2494 | Artemisia capillaris | Yin Chen Hao | 茵陈蒿 |
| TCMH2080 | Sophora flavescens | Teng Ku Shen | è—¤è‹¦å‚ |
| TCMH2276 | Elsholtzia splendens | Xiang Ru | 香薷 |
| TCMH2554 | Polygala tenuifolia | Yuan Zhi | 远志 |
| TCMH2555 | Polygala tenuifolia | Yuan Zhi Jin Gao | è¿œå¿—æµ¸è† |
| TCMH2316 | Magnolia liliflora | Xin Yi | 辛夷 |
| TCMH2317 | Magnolia liliflora | Xin Yi Hua | 辛夷花 |
| TCMH2319 | Magnolia liliflora | Xin Yi Hua Jin Gao Fen | 辛夷花浸è†ç²‰ |
| TCMH2164 | Clematis chinensis | Wei Ling | å¨çµ |
Ingredient ID: TCMC1493
Formula: C10H18O
Ingredient ID: TCMC1493
| Common Name | Linalool (+) |
| IUPAC Name | (3R)-3,7-dimethylocta-1,6-dien-3-ol |
| Canonical SMILES | C=C[C@@](CCC=C(C)C)(O)C |
| Standard InCHI | InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3/t10-/m0/s1 |
| Standard InCHIKey | CDOSHBSSFJOMGT-JTQLQIEISA-N |
| External Identifiers | ChEMBL [CHEMBL235672]; PubChem [443158]; |
| Reference of Component-Ingredient Pair | 22394400 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1533 | Saussurea lappa | Mu Xiang | 木香 |
| TCMH907 | Piper nigrum | Hu Jiao | 胡椒 |
| TCMH1063 | Curcuma longa | Jiang Huang | 姜黄 |
| TCMH1126 | Craibiodendron yunnanese | Jin Ye Zi | 金å¶å |
| TCMH7 | Ardisiae japonicae | Ai Di Cha Qing Gao | çŸ®åœ°èŒ¶æ¸…è† |
| TCMH924 | Zanthoxylum bungeanum | Hua Jiao | 花椒 |
| TCMH265 | Laggera pterodonta | Chu Ling Dan Cao | è‡çµä¸¹è‰ |
| TCMH1753 | Boswellia carterii | Ru Xiang | 乳香 |
| TCMH1144 | Schizonepetae herba | Jing Jie Tan | è†èŠ¥ç‚ |
| TCMH953 | Aconitum vilmorinianum | Huang Cao Wu | 黄è‰ä¹Œ |
| TCMH1165 | Murraya paniculata | Jiu Li Xiang | ä¹é‡Œé¦™ |
| TCMH497 | Atalantia buxifolia | Dong Feng Ju | 东风橘 |
| TCMH491 | Oleum ocimi gratissimi | Ding Xiang Luo Le You | ä¸é¦™ç½—å‹’æ²¹ |
| TCMH307 | Cnidium officinale | Chuan Xiong Jin Gao | å·èŠŽæµ¸è† |
| TCMH316 | Ailanthi cortex | Chun Pi | 椿皮 |
| TCMH2003 | Kyllinga brevifolia | Shui Wu Gong | 水蜈蚣 |
| TCMH607 | Exodermis poria | Fu Ling Pi | 茯苓皮 |
| TCMH1343 | Aloe vera | Lu Hui | èŠ¦èŸ |
| TCMH873 | Radix et rhizoma rhodiolae | Hong Jing Tian | 红景天 |
| TCMH1923 | Acorus tatarinowii | Shi Chang Pu Qing Gao | 石è–è’²æ¸…è† |
| TCMH1825 | Litsea cubeba | Shan Jiang Zi | 山姜å |
| TCMH1609 | Eupatorium fortunei | Pei Lan | 佩兰 |
| TCMH1894 | Pinellia ternata | Sheng Ban Xia | 生åŠå¤ |
| TCMH215 | Alpinia katsumadai | Cao Dou Kou Ren | è‰è±†è”»ä» |
| TCMH1979 | Flos lonicerae | Shuang Hua | åŒèŠ± |
| TCMH290 | Radix cudraniae | Chuan Po Shi | ç©¿ç ´çŸ³ |
| TCMH108 | Perilla frutescens | Bai Su Zi | 白è‹å |
| TCMH422 | Angelica sinensis | Dang Gui Gan Jin Gao | å½“å½’å¹²æµ¸è† |
| TCMH1432 | Vitex trifolia | Man Jing Zi | 蔓è†å |
| TCMH243 | Pericarpium citri reticulatae | Chen Pi | 陈皮 |
| TCMH829 | Semen pharbitidis | Hei Chou | 黑丑 |
| TCMH685 | Syzygium aromaticum | Gong Ding Xiang | å…¬ä¸é¦™ |
| TCMH1611 | Rhizoma curcumae | Peng E Zhu | 蓬莪术 |
| TCMH1518 | Chaenomeles sinensis | Mu Gua | 木瓜 |
| TCMH670 | Ligusticum sinense | Gao Ben | è—本 |
| TCMH1033 | Centella asiatica | Ji Xue Cao | ç§¯é›ªè‰ |
| TCMH1486 | Ephedra sinica | Mi Ma Huang | 蜜麻黄 |
| TCMH1661 | Rhizoma homalomenae occultae | Qian Nian Jian | åƒå¹´å¥ |
| TCMH1117 | Rhizoma fagopyri cymosi | Jin Qiao Mai | 金èžéº¦ |
| TCMH970 | Vitex negundo | Huang Jing Zi | 黄è†å |
| TCMH1000 | Foeniculum vulgare | Hui Xiang | 茴香 |
| TCMH1903 | Zingiber officinale | Sheng Jiang | 生姜 |
| TCMH447 | Illicium difengpi | Di Feng Pi | 地枫皮 |
| TCMH1531 | Akebia quinata | Mu Tong | 木通 |
| TCMH1179 | Citri exocarpium rubrum | Ju Hong | 橘红 |
| TCMH148 | Glehnia littoralis | Bei Sha Shen Liu Jin Gao | 北沙å‚æµæµ¸è† |
| TCMH1272 | Forsythia suspensa | Lian Qiao | 连翘 |
| TCMH160 | Piper cubeba | Bi Cheng Qie | 毕澄茄 |
| TCMH132 | Scutellaria barbata | Ban Zhi Lian | åŠæžèŽ² |
| TCMH1970 | Pericarpium zanthoxyli | Shu Jiao | 蜀椒 |
| TCMH203 | Acorus calamus | Cang Chang Pu | è—è–è’² |
| TCMH1741 | Myristica fragrans | Rou Dou Kou | 肉豆蔻 |
| TCMH1029 | Paederia scandens | Ji Shi Teng | 鸡矢藤 |
| TCMH1804 | Amomum villosum | Sha Ren Ye | ç ‚ä»å¶ |
| TCMH1184 | Citrus reticulata | Ju Pi | 橘皮 |
| TCMH1714 | Lonicera japonica | Ren Dong Teng | å¿å†¬è—¤ |
| TCMH13 | Artemisia argyi | Ai Ye You | 艾å¶æ²¹ |
| TCMH214 | Alpinia katsumadai | Cao Dou Kou | è‰è±†è”» |
| TCMH1846 | Artemisia capillaris | Shan Yin Chen | 山茵陈 |
| TCMH1803 | Amomum villosum | Sha Ren | ç ‚ä» |
| TCMH1127 | Lonicera japonica | Jin Yin Hua | 金银花 |
| TCMH1128 | Lonicera japonica | Jin Yin Hua Ti Qu Ye | 金银花æå–液 |
| TCMH421 | Angelica sinensis | Dang Gui | 当归 |
| TCMH1292 | Radix smilacis | Ling Xian | çµä»™ |
| TCMH1225 | Valeriana officinalis | Kuan Ye Xie Cao | 宽å¶ç¼¬è‰ |
| TCMH52 | Semen pharbitidis | Bai Chou | 白丑 |
| TCMH1734 | Homo sapiens | Ren Zhong Bai | 人ä¸ç™½ |
| TCMH1398 | Ephedra sinica | Ma Huang | 麻黄 |
| TCMH1399 | Ephedra sinica | Ma Huang Gao | éº»é»„è† |
| TCMH1400 | Ephedra sinica | Ma Huang Gen | éº»é»„æ ¹ |
| TCMH1401 | Ephedra sinica | Ma Huang Jin Gao | éº»é»„æµ¸è† |
| TCMH130 | Pinellia ternata | Ban Xia | åŠå¤ |
| TCMH131 | Pinellia ternata | Ban Xia Qu | åŠå¤æ›² |
| TCMH1677 | Pinellia ternata | Qing Ban Xia | 清åŠå¤ |
| TCMH1215 | Sophora flavescens | Ku Shen | è‹¦å‚ |
| TCMH544 | Curcuma aeruginosa | E Zhu | 莪术 |
| TCMH740 | Rhizoma curcumae | Guang Xi E Zhu | 广西莪术 |
| TCMH1431 | Vitex trifolia | Man Jing Ye | 蔓è†å¶ |
| TCMH309 | Curcuma longa | Chuan Yu Jin | å·éƒé‡‘ |
| TCMH1178 | Citrus reticulata | Ju He | æ©˜æ ¸ |
| TCMH458 | Pericarpium citri reticulatae viride | Di Qing Pi | 地é’çš® |
| TCMH1695 | Pericarpium citri reticulatae viride | Qing Pi | é’çš® |
| TCMH496 | Atalantia buxifolia | Dong Feng Jie | 东风桔 |
| TCMH12 | Artemisia argyi | Ai Ye | è‰¾å¶ |
| TCMH6 | Ardisiae japonicae | Ai Di Cha | 矮地茶 |
| TCMH264 | Laggera pterodonta | Chu Ling Dan | è‡çµä¸¹ |
| TCMH64 | Piper nigrum | Bai Hu Jiao | 白胡椒 |
| TCMH839 | Piper nigrum | Hei Hu Jiao | 黑胡椒 |
| TCMH511 | Litsea cubeba | Dou Chi Jiang | 豆豉姜 |
| TCMH1812 | Litsea cubeba | Shan Cang Zi | å±±è‹å |
| TCMH228 | Bupleurum chinense | Chai Hu | 柴胡 |
| TCMH229 | Bupleurum chinense | Chai Hu Jin Gao | æŸ´èƒ¡æµ¸è† |
| TCMH230 | Bupleurum chinense | Chai Hu Shao | 柴胡梢 |
| TCMH60 | Ginkgo biloba | Bai Guo | 白果 |
| TCMH61 | Ginkgo biloba | Bai Guo Ren | ç™½æžœä» |
| TCMH305 | Cnidium officinale | Chuan Xiong | å·èŠŽ |
| TCMH486 | Syzygium aromaticum | Ding Xiang | ä¸é¦™ |
| TCMH253 | Citrus aurantium | Cheng Pi | 橙皮 |
| TCMH1920 | Acorus tatarinowii | Shi Chang Pu | 石è–è’² |
| TCMH1922 | Acorus tatarinowii | Shi Chang Pu Jin Gao | 石è–è’²æµ¸è† |
| TCMH147 | Glehnia littoralis | Bei Sha Shen | åŒ—æ²™å‚ |
| TCMH1856 | Gardenia jasminoides | Shan Zhi | å±±æ € |
| TCMH2407 | Bupleurum chinense | Yan Tai Chai Hu | 烟å°æŸ´èƒ¡ |
| TCMH2039 | Caulis perillae frutescentis | Su Geng | è‹æ¢— |
| TCMH2630 | Citrus aurantium | Zhi Shi | 枳实 |
| TCMH2506 | Ginkgo biloba | Yin Xing Ye | 银æå¶ |
| TCMH2166 | Clematis chinensis | Wei Ling Xian | å¨çµä»™ |
| TCMH2495 | Artemisia capillaris | Yin Chen Hao Gan Jin Gao | èŒµé™ˆè’¿å¹²æµ¸è† |
| TCMH2201 | Securidaca inappendiculata | Wu Wei Teng | 五味藤 |
| TCMH2143 | Sophora flavescens | Tu Ku Shen | åœŸè‹¦å‚ |
| TCMH2144 | Inula helenium | Tu Mu Xiang | 土木香 |
| TCMH2303 | Pericarpium citri reticulatae viride | Xiao Qing Pi | å°é’çš® |
| TCMH2244 | Prunella vulgaris | Xia Ku Cao | å¤æž¯è‰ |
| TCMH2491 | Alpinia oxyphylla | Yi Zhi Ren | ç›Šæ™ºä» |
| TCMH2642 | Gardenia jasminoides | Zhi Zi Jin Gao | æ €åæµ¸è† |
| TCMH2710 | Homo sapiens | Zi He Che | 紫河车 |
| TCMH2112 | Radix smilacis | Tie Si Wei Ling Xian | é“ä¸å¨çµä»™ |
| TCMH2239 | Asarum sieboldii | Xi Xin | 细辛 |
| TCMH2322 | Prunus armeniaca | Xing Ren | æä» |
| TCMH2651 | Elsholtzia splendens | Zhou Ye Xiang Ru | çš±å¶é¦™è–· |
| TCMH2206 | Schisandra chinensis | Wu Wei Zi Liu Jin Gao | 五味åæµæµ¸è† |
| TCMH2545 | Houttuynia cordata | Yu Xing Cao | é±¼è…¥è‰ |
| TCMH2452 | Chrysanthemum indicum | Ye Ju Hua | 野èŠèŠ± |
| TCMH2698 | Valeriana officinalis | Zhua Di Hu | 抓地虎 |
| TCMH2101 | Eupatorium rebaudianum | Tian Ye Ju | 甜å¶èŠ |
| TCMH2320 | Magnolia liliflora | Xin Yi Ren | è¾›å¤·ä» |
| TCMH2558 | Rosa chinensis | Yue Ji Hua | 月å£èŠ± |
| TCMH2055 | Fructus amomi | Suo Sha Ren | ç¼©ç ‚ä» |
| TCMH2267 | Periploca sepium | Xiang Jia Pi | é¦™åŠ çš® |
| TCMH2180 | Ficus carica | Wu Hua Guo | æ— èŠ±æžœ |
| TCMH2722 | Perilla frutescens var. arguta | Zi Su Ye | ç´«è‹å¶ |
| TCMH2282 | Citrus medica | Xiang Yuan Pi | 香橼皮 |
| TCMH2213 | Ipomoea cairica | Wu Zhao Long | 五爪龙 |
| TCMH2211 | Artemisia princeps | Wu Yue Ai | 五月艾 |
| TCMH2154 | Artemisia capillaris | Tu Yin Chen Hao | 土茵陈蒿 |
| TCMH2494 | Artemisia capillaris | Yin Chen Hao | 茵陈蒿 |
| TCMH2281 | Citrus medica | Xiang Yuan | 香橼 |
| TCMH2310 | Valeriana officinalis | Xie Cao | ç¼¬è‰ |
| TCMH2080 | Sophora flavescens | Teng Ku Shen | è—¤è‹¦å‚ |
| TCMH2488 | Alpinia oxyphylla | Yi Zhi | 益智 |
| TCMH2276 | Elsholtzia splendens | Xiang Ru | 香薷 |
| TCMH2316 | Magnolia liliflora | Xin Yi | 辛夷 |
| TCMH2317 | Magnolia liliflora | Xin Yi Hua | 辛夷花 |
| TCMH2319 | Magnolia liliflora | Xin Yi Hua Jin Gao Fen | 辛夷花浸è†ç²‰ |
| TCMH2164 | Clematis chinensis | Wei Ling | å¨çµ |
| TCMH2613 | Citrus aurantium | Zhi Geng | 枳梗 |
| TCMH2618 | Citrus aurantium | Zhi Ke | 枳壳 |
| TCMH2619 | Citrus aurantium | Zhi Ke Gan Jin Gao | æž³å£³å¹²æµ¸è† |
| TCMH2202 | Schisandra chinensis | Wu Wei Zi | 五味å |
| TCMH2203 | Schisandra chinensis | Wu Wei Zi Chun Jin Gao | 五味åé†‡æµ¸è† |
| TCMH2204 | Schisandra chinensis | Wu Wei Zi Jin Chu Wu | 五味å浸出物 |
| TCMH2205 | Schisandra chinensis | Wu Wei Zi Jin Gao | 五味åæµ¸è† |
| TCMH2721 | Perilla frutescens var. arguta | Zi Su Geng | ç´«è‹æ¢— |
| TCMH2641 | Gardenia jasminoides | Zhi Zi | æ €å |
Ingredient ID: TCMC1101
Formula: C11H12O3
Ingredient ID: TCMC1101
| Common Name | Elemicin |
| IUPAC Name | 4-methoxy-6-prop-2-enyl-1,3-benzodioxole |
| Canonical SMILES | C=CCc1cc(OC)c2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C11H12O3/c1-3-4-8-5-9(12-2)11-10(6-8)13-7-14-11/h3,5-6H,1,4,7H2,2H3 |
| Standard InCHIKey | BNWJOHGLIBDBOB-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL481044]; PubChem [4276]; |
| Reference of Component-Ingredient Pair | 29174417 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1862 | Cornus officinalis | Shan Zhu Yu | å±±èŒ±è¸ |
| TCMH865 | Carthamus tinctorius | Hong Hua | 红花 |
| TCMH512 | Fructus amomi rotundus | Dou Kou | 豆蔻 |
| TCMH463 | Sanguisorba officinalis | Di Yu Tan | åœ°æ¦†ç‚ |
| TCMH25 | Styrax benzoin | An Xi Xiang | 安æ¯é¦™ |
| TCMH1051 | Piper sarmentosum | Jia è’Ÿye | å‡è’Ÿå¶ |
| TCMH108 | Perilla frutescens | Bai Su Zi | 白è‹å |
| TCMH428 | Codonopsis pilosula | Dang Shen Qing Gao | å…šå‚æ¸…è† |
| TCMH422 | Angelica sinensis | Dang Gui Gan Jin Gao | å½“å½’å¹²æµ¸è† |
| TCMH1432 | Vitex trifolia | Man Jing Zi | 蔓è†å |
| TCMH388 | Ziziphus jujuba | Da Zao | 大枣 |
| TCMH1551 | Asarum forbesii | Nan Xi Xin | å—细辛 |
| TCMH1966 | Rehmannia glutinosa | Shu Di Huang | 熟地黄 |
| TCMH30 | Croton tiglium | Ba Dou Ye | å·´è±†å¶ |
| TCMH1665 | Notopterygium incisum | Qiang Huo | 羌活 |
| TCMH670 | Ligusticum sinense | Gao Ben | è—本 |
| TCMH1000 | Foeniculum vulgare | Hui Xiang | 茴香 |
| TCMH1741 | Myristica fragrans | Rou Dou Kou | 肉豆蔻 |
| TCMH358 | Areca catechu | Da Fu Zi | 大腹å |
| TCMH1846 | Artemisia capillaris | Shan Yin Chen | 山茵陈 |
| TCMH1175 | Cornus officinalis | Jiu Yu Rou | é…’è¸è‚‰ |
| TCMH421 | Angelica sinensis | Dang Gui | 当归 |
| TCMH1292 | Radix smilacis | Ling Xian | çµä»™ |
| TCMH426 | Codonopsis pilosula | Dang Shen | å…šå‚ |
| TCMH516 | Asarum forbesii | Du Heng | æœè¡¡ |
| TCMH1431 | Vitex trifolia | Man Jing Ye | 蔓è†å¶ |
| TCMH705 | Trichosanthes kirilowii | Gua Lou | 瓜蒌 |
| TCMH706 | Trichosanthes kirilowii | Gua Lou Pi | 瓜蒌皮 |
| TCMH707 | Trichosanthes kirilowii | Gua Lou Ren | ç“œè’Œä» |
| TCMH708 | Trichosanthes kirilowii | Gua Lou Ren Shuang | 瓜蒌ä»éœœ |
| TCMH709 | Trichosanthes kirilowii | Gua Lou Shi | æ 蒌实 |
| TCMH711 | Trichosanthes kirilowii | Gua Lou Gen | æ æ¥¼æ ¹ |
| TCMH712 | Trichosanthes kirilowii | Gua Lou Ren(1) | æ æ¥¼ä» |
| TCMH462 | Sanguisorba officinalis | Di Yu | 地榆 |
| TCMH1045 | Piper sarmentosum | Jia Ju | å‡è’Ÿ |
| TCMH28 | Croton tiglium | Ba Dou | 巴豆 |
| TCMH29 | Croton tiglium | Ba Dou Shuang | 巴豆霜 |
| TCMH292 | Notopterygium incisum | Chuan Qiang Huo | å·ç¾Œæ´» |
| TCMH182 | Areca catechu | Bing Lang | 槟榔 |
| TCMH8 | Rehmannia glutinosa | Ai Di Huang | 矮地黄 |
| TCMH451 | Rehmannia glutinosa | Di Huang | 地黄 |
| TCMH453 | Rehmannia glutinosa | Di Huang Tan | åœ°é»„ç‚ |
| TCMH643 | Rehmannia glutinosa | Gan Di Huang | 干地黄 |
| TCMH2166 | Clematis chinensis | Wei Ling Xian | å¨çµä»™ |
| TCMH2495 | Artemisia capillaris | Yin Chen Hao Gan Jin Gao | èŒµé™ˆè’¿å¹²æµ¸è† |
| TCMH2153 | Asarum caulescens | Tu Xi Xin | 土细辛 |
| TCMH2112 | Radix smilacis | Tie Si Wei Ling Xian | é“ä¸å¨çµä»™ |
| TCMH2239 | Asarum sieboldii | Xi Xin | 细辛 |
| TCMH2322 | Prunus armeniaca | Xing Ren | æä» |
| TCMH2651 | Elsholtzia splendens | Zhou Ye Xiang Ru | çš±å¶é¦™è–· |
| TCMH2086 | Trichosanthes kirilowii | Tian Hua Fen | 天花粉 |
| TCMH2314 | Conioselinum vaginatum | Xin Jiang Gao Ben | æ–°ç–†è—本 |
| TCMH2055 | Fructus amomi | Suo Sha Ren | ç¼©ç ‚ä» |
| TCMH2213 | Ipomoea cairica | Wu Zhao Long | 五爪龙 |
| TCMH2593 | Octopus vulgaris | Zhang Yu | ç« é±¼ |
| TCMH2154 | Artemisia capillaris | Tu Yin Chen Hao | 土茵陈蒿 |
| TCMH2494 | Artemisia capillaris | Yin Chen Hao | 茵陈蒿 |
| TCMH2276 | Elsholtzia splendens | Xiang Ru | 香薷 |
| TCMH2164 | Clematis chinensis | Wei Ling | å¨çµ |
Properties
| Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TCMC463 | C14H12N2S | 4-(1,3-Benzothiazol-2-Yl)-2-Methylaniline | 240.07 | 0.4827 | 2.67 | 3.571 | 2 | 1 | 67.15 | 3 | 3 | 17 | 0 |
| TCMC696 | C10H12O | Anethole | 148.09 | 0.8555 | 2.45 | 3.979 | 0 | 0 | 9.23 | 4 | 1 | 11 | 0 |
| TCMC999 | C10H20O2 | Decanoic Acid | 172.15 | -2.1697 | 2.34 | 4.156 | 2 | 1 | 37.3 | 10 | 0 | 12 | 0 |
| TCMC1101 | C11H12O3 | Elemicin | 192.08 | 0.6742 | 2.34 | 2.486 | 0 | 0 | 27.69 | 4 | 2 | 14 | 0 |
| TCMC1493 | C10H18O | Linalool (+) | 154.14 | 2.4692 | 2.45 | 2.468 | 1 | 1 | 20.23 | 8 | 0 | 11 | 0 |
| TCMC1578 | C11H14O2 | Methyleugenol | 178.1 | 0.9251 | 2.45 | 3.003 | 0 | 0 | 18.46 | 6 | 1 | 13 | 0 |
| TCMC1777 | C8H18O | Octanol | 130.14 | -2.1254 | 2.23 | 3.127 | 1 | 1 | 20.23 | 8 | 0 | 9 | 0 |
| TCMC2166 | C10H14O | Thymol | 150.1 | 0.7546 | 2.45 | 3.556 | 0 | 1 | 20.23 | 5 | 1 | 11 | 0 |
| TCMC2541 | C10H18O | Alpha-Terpineol | 154.14 | 1.1223 | 2.45 | 2.369 | 1 | 1 | 20.23 | 5 | 1 | 11 | 0 |
Download Data
All data can be downloaded by:→ Selecting data type in the below download table
→ Then click the download button.
