Description of the Component
Component ID |
TCMH2693 |
Latin Name |
Fructus gleditsiae abnormalis |
English Name |
Chinese honeylocust abnormal fruit |
Chinese Pinyin Name |
Zhu Ya Zao |
中文名 |
猪牙皂 |
TCM Properties |
|
TCM Meridians |
|
Therapeutic Class English |
For desolving phlegm, stopping cougth, and soothing breathing |
Therapeutic Class Chinese |
化痰止咳平喘 |
Functions |
dispel phlegm , restore consciousness, and reduce modulation and cause the subsidence of swelling |
Toxicity |
NA |
Geo-authentic habitats (道地产区) |
Shandong Province |
Reference |
Chinese Pharmacopoeia (2015) |
Barcode ID |
|
Barcode Source |
TCM Prescriptions with the Component
| Prescription ID | Prescription English Name | Prescription Chinese Name |
|---|---|---|
| TCMF2970 | Ba Xian You | 八仙油 |
| TCMF3375 | Feng Shi Gao Yao | 风湿膏药 |
| TCMF3561 | Gu Zeng Sheng Zhen Tong Ointment | 骨增生镇痛膏 |
| TCMF3823 | Fu Fang Niu Huang Qing Wei Pills | 复方牛黄清胃丸 |
| TCMF4417 | Huo Xue Pills | 活血丸 |
| TCMF4586 | Liu Yu Pills | 六郁丸 |
| TCMF5069 | Qu Feng Su He Pills | 驱风苏合丸 |
| TCMF5332 | Wan Ling Jin Gu Ointment | 万灵筋骨膏 |
| TCMF5385 | Wan Ying Bao Zhen Ointment | 万应宝珍膏 |
| TCMF5650 | Wei Huo Ling Tablets | 胃活灵片 |
Showing 1 to 10 of 59 entries
Targeted Human Proteins by the Ingredient of Component
| Target ID | Gene Symbol | Target Name | Target Class | Uniprot ID |
|---|---|---|---|---|
| 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 |
Showing 1 to 4 of 4 entries
Targeted Pathogenic Microbes by the Ingredient of Component
| Target ID | Target Name |
|---|---|
| TCMT1251 | Candida albicans |
| TCMT1438 | Plasmodium falciparum |
| TCMT1458 | Filobasidiella neoformans |
| TCMT1465 | Entamoeba histolytica |
Showing 1 to 4 of 4 entries
Ingredient Structrues
Ingredient ID: TCMC887
Formula: C16H34O
Ingredient ID: TCMC887
| Common Name | Cetyl Alcohol |
| IUPAC Name | hexadecan-1-ol |
| Canonical SMILES | CCCCCCCCCCCCCCCCO |
| Standard InCHI | InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3 |
| Standard InCHIKey | BXWNKGSJHAJOGX-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL706]; PubChem [2682]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH12 | Artemisia argyi | Ai Ye | 艾叶 |
| TCMH13 | Artemisia argyi | Ai Ye You | 艾叶油 |
| TCMH1734 | Homo sapiens | Ren Zhong Bai | 人中白 |
| TCMH1846 | Artemisia capillaris | Shan Yin Chen | 山茵陈 |
| TCMH2154 | Artemisia capillaris | Tu Yin Chen Hao | 土茵陈蒿 |
| TCMH2211 | Artemisia princeps | Wu Yue Ai | 五月艾 |
| TCMH2369 | Gleditsia sinensis | Ya Zao | 牙皂 |
| TCMH2494 | Artemisia capillaris | Yin Chen Hao | 茵陈蒿 |
| TCMH2495 | Artemisia capillaris | Yin Chen Hao Gan Jin Gao | 茵陈蒿干浸膏 |
| TCMH2569 | Gleditsia sinensis | Zao Jia | 皂荚 |
Showing 1 to 10 of 19 entries
Ingredient ID: TCMC801
Formula: C29H50O
Ingredient ID: TCMC801
| 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 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1008 | Pogostemon cablin | Huo Xiang | 藿香 |
| TCMH1009 | Pogostemon cablin | Huo Xiang Ye | 藿香叶 |
| TCMH1011 | Sargentodoxa cuneata | Huo Xue Teng | 活血藤 |
| TCMH1017 | Oxytropis myriophylla | Ji Dou | 棘豆 |
| TCMH1032 | Impatiens balsamina | Ji Xing Zi | 急性子 |
| TCMH1033 | Centella asiatica | Ji Xue Cao | 积雪草 |
| TCMH1045 | Piper sarmentosum | Jia Ju | 假蒟 |
| TCMH1051 | Piper sarmentosum | Jia 蒟ye | 假蒟叶 |
| TCMH1063 | Curcuma longa | Jiang Huang | 姜黄 |
| TCMH1064 | Coptis chinensis | Jiang Huang Lian | 姜黄连 |
Showing 1 to 10 of 331 entries
Ingredient ID: TCMC5883
Formula: C29H50O
Ingredient ID: TCMC5883
| Common Name | sitosterol |
| IUPAC Name | (3R,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-ZFVHJZABSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [12303645]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC3244
Formula: C30H48O4
Ingredient ID: TCMC3244
| Common Name | echinocystic acid |
| IUPAC Name | (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-5,10-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
| Canonical SMILES | O[C@@H]1C[C@]2(C)C(=CC[C@H]3[C@@]2(C)CC[C@@H]2[C@]3(C)CC[C@@H](C2(C)C)O)[C@H]2[C@@]1(CCC(C2)(C)C)C(=O)[O-] |
| Standard InCHI | InChI=1S/C30H48O4/c1-25(2)14-15-30(24(33)34)19(16-25)18-8-9-21-27(5)12-11-22(31)26(3,4)20(27)10-13-28(21,6)29(18,7)17-23(30)32/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/p-1/t19-,20-,21+,22-,23+,27-,28+,29+,30+/m0/s1 |
| Standard InCHIKey | YKOPWPOFWMYZJZ-PRIAQAIDSA-M |
| External Identifiers | ChEMBL [CHEMBL230128]; PubChem [73309]; |
| Reference of Component-Ingredient Pair | 24623716 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC3218
Formula: C26H54O
Ingredient ID: TCMC3218
| Common Name | Ceryl Alcohol,Hexacosanol |
| IUPAC Name | hexacosan-1-ol |
| Canonical SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCO |
| Standard InCHI | InChI=1S/C26H54O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27/h27H,2-26H2,1H3 |
| Standard InCHIKey | IRHTZOCLLONTOC-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [68171]; |
| Reference of Component-Ingredient Pair | 22536429 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC3068
Formula: C29H60
Ingredient ID: TCMC3068
| Common Name | Nonacosane |
| IUPAC Name | nonacosane |
| Canonical SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
| Standard InCHI | InChI=1S/C29H60/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-29H2,1-2H3 |
| Standard InCHIKey | IGGUPRCHHJZPBS-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL428955]; PubChem [12409]; |
| Reference of Component-Ingredient Pair | 22292044 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1219 | Semen armeniacae amarum | Ku Xing Ren | 苦杏仁 |
| TCMH1368 | Apocyni veneti folium | Luo Bu Ma Ye | 罗布麻叶 |
| TCMH1721 | Panax ginseng | Ren Shen | 人参 |
| TCMH1813 | Asarum sagittarioides | Shan Ci Gu | 山慈菇 |
| TCMH2128 | Rhizoma bolbostemmae | Tu Bei Mu | 土贝母 |
| TCMH2252 | Agrimonia pilosa var. japonica | Xian He Cao | 仙鹤草 |
| TCMH2641 | Gardenia jasminoides | Zhi Zi | 栀子 |
| TCMH2693 | Fructus gleditsiae abnormalis | Zhu Ya Zao | 猪牙皂 |
| TCMH389 | Gleditsiae sinensis fructus | Da Zao Jiao | 大皂角 |
| TCMH524 | Eucommia ulmoides | Du Zhong | 杜仲 |
Showing 1 to 10 of 13 entries
Properties
| Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TCMC3068 | C29H60 | Nonacosane | 408.4695019 | -7.6734 | 4.65 | 16.841 | 0 | 0 | 0 | 26 | 0 | 29 | 2 |
| TCMC3218 | C26H54O | Ceryl Alcohol,Hexacosanol | 382.4174663 | -7.3094 | 4.21 | 13.369 | 1 | 1 | 20.23 | 24 | 0 | 27 | 2 |
| TCMC3244 | C30H48O4 | echinocystic acid | 471.347435 | 0.8789 | 4.32 | 7.119 | 4 | 2 | 80.59 | 1 | 5 | 34 | 1 |
| TCMC5883 | C29H50O | sitosterol | 414.3861662 | 1.3 | 4.54 | 11.595 | 1 | 1 | 20.23 | 6 | 4 | 30 | 1 |
| TCMC801 | C29H50O | Beta-Sitosterol | 414.39 | 1.3 | 4.54 | 11.595 | 1 | 1 | 20.23 | 13 | 4 | 30 | 1 |
| TCMC887 | C16H34O | Cetyl Alcohol | 242.26 | -4.4294 | 3.11 | 7.679 | 1 | 1 | 20.23 | 16 | 0 | 17 | 2 |
Showing 1 to 6 of 6 entries
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