Component ID |
TCMH1084 |
Latin Name |
Platycodon grandiflorum |
English Name |
Balloonflower |
Chinese Pinyin Name |
Jie Geng Liu Jin Gao |
中文名 |
桔梗流浸膏 |
TCM Properties |
|
TCM Meridians |
|
Therapeutic Class English |
|
Therapeutic Class Chinese |
|
Functions |
|
Toxicity |
NA |
Geo-authentic habitats (道地产区) |
NA |
Reference |
Chinese Pharmacopoeia (2015) |
Barcode ID |
ITSAJ4293-14 |
Barcode Source |
BOLDSYSTEMS |
Prescription ID | Prescription English Name | Prescription Chinese Name |
---|---|---|
TCMFx234 | Xiao Er Zhi Ke Syrup | 小儿止咳糖浆 |
TCMFx2945 | An Sou Syrup | 安嗽糖浆 |
TCMFx4707 | Lai Yang Li Zhi Ke Granules | 莱阳梨止咳颗粒 |
TCMFx4715 | Lai Yang Li Zhi Ke Oral Liquid | 莱阳梨止咳口服液 |
TCMFx4723 | Lai Yang Li Zhi Ke Syrup | 莱阳梨止咳糖浆 |
TCMFx5013 | Su Fei Ke Syrup | 苏菲咳糖浆 |
TCMFx5256 | Shu Fei Syrup | 舒肺糖浆 |
TCMFx5503 | Tian Yi Zhi Ke Syrup | 天一止咳糖浆 |
TCMFx6202 | Xing Ren Zhi Ke Infusion | 杏仁止咳冲剂 |
TCMFx6523 | Xiao Er Zhi Ke Syrup | 小儿止咳糖浆 |
Target ID | Gene Symbol | Target Name | Target Class | Uniprot ID |
---|---|---|---|---|
TCMT101 | PTPN1 | Protein-tyrosine phosphatase 1B | Hydrolase | P18031 |
TCMT102 | ACP1 | Low molecular weight phosphotyrosine protein phosphatase | Hydrolase | P24666 |
TCMT103 | PTPRF | Receptor-type tyrosine-protein phosphatase F (LAR) | Hydrolase | P10586 |
TCMT171 | PTPN6 | Protein-tyrosine phosphatase 1C | Hydrolase | P29350 |
TCMT190 | PTPN2 | T-cell protein-tyrosine phosphatase | Hydrolase | P17706 |
TCMT214 | MGLL | Monoglyceride lipase | Unclassified | Q99685 |
TCMT223 | AKR1B1 | Aldose reductase | Oxidoreductase | P15121 |
TCMT233 | PTPN11 | Protein-tyrosine phosphatase 2C | Hydrolase | Q06124 |
TCMT273 | NR1H4 | Bile acid receptor FXR | Nuclear receptor | Q96RI1 |
TCMT280 | AKR1B10 | Aldo-keto reductase family 1 member B10 | Oxidoreductase | O60218 |
Target ID | Target Name |
---|---|
TCMT1107 | Protease |
TCMT1178 | Actinomyces viscosus |
TCMT1229 | Enterococcus faecalis |
TCMT1248 | Hepatitis C virus |
TCMT1255 | Human immunodeficiency virus 1 |
TCMT1354 | Streptococcus mutans UA159 |
TCMT1454 | Bacillus subtilis |
TCMT1462 | Streptococcus mutans |
TCMT1463 | Mycobacterium tuberculosis |
Ingredient ID: TCMC2696
Formula: C28H56O2
Common Name | N-Octacosanoic Acid |
IUPAC Name | octacosanoic acid |
Canonical SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O |
Standard InCHI | InChI=1S/C28H56O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28(29)30/h2-27H2,1H3,(H,29,30) |
Standard InCHIKey | UTOPWMOLSKOLTQ-UHFFFAOYSA-N |
External Identifiers | ChEMBL [CHEMBL2261064]; PubChem [10470]; |
Reference of Component-Ingredient Pair | N/A |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH1080 | Platycodon grandiflorum | Jie Geng | 桔梗 |
TCMH1082 | Platycodon grandiflorum | Jie Geng Gan Gao | 桔梗干膏 |
TCMH1083 | Platycodon grandiflorum | Jie Geng Gan Gao Fen | 桔梗干膏粉 |
TCMH1084 | Platycodon grandiflorum | Jie Geng Liu Jin Gao | 桔梗流浸膏 |
TCMH1085 | Platycodon grandiflorum | Jie Geng Liu Zhu Gao | 桔梗流注膏 |
TCMH1305 | Laggera alata | Liu Ling Ju | 六棱菊 |
TCMH1866 | Cnidium monnieri | She Chuang Zi | 蛇床子 |
TCMH1872 | Cnidium monnieri | She Ma Zi | 蛇麻子 |
TCMH210 | Terminalia chebula | Cang Qing Guo | 藏青果 |
TCMH2356 | Daemonorops draco | Xue Xie | 血蝎 |
Ingredient ID: TCMC2411
Formula: C30H48O3
Common Name | Epi-Oleanolic Acid |
IUPAC Name | (4aS,6aR,6aS,6bR,8aR,10R,12aR,14bS)-10-hydroxy-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]1CC[C@]2([C@H](C1(C)C)CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC(C)(C)CC1)C(=O)O)C)C |
Standard InCHI | InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23+,27-,28+,29+,30-/m0/s1 |
Standard InCHIKey | MIJYXULNPSFWEK-KDQGZELNSA-N |
External Identifiers | ChEMBL [CHEMBL486382]; PubChem [11869658]; |
Reference of Component-Ingredient Pair | 25172756 |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH1000 | Foeniculum vulgare | Hui Xiang | 茴香 |
TCMH1008 | Pogostemon cablin | Huo Xiang | 藿香 |
TCMH1009 | Pogostemon cablin | Huo Xiang Ye | 藿香叶 |
TCMH108 | Perilla frutescens | Bai Su Zi | 白苏子 |
TCMH1080 | Platycodon grandiflorum | Jie Geng | 桔梗 |
TCMH1082 | Platycodon grandiflorum | Jie Geng Gan Gao | 桔梗干膏 |
TCMH1083 | Platycodon grandiflorum | Jie Geng Gan Gao Fen | 桔梗干膏粉 |
TCMH1084 | Platycodon grandiflorum | Jie Geng Liu Jin Gao | 桔梗流浸膏 |
TCMH1085 | Platycodon grandiflorum | Jie Geng Liu Zhu Gao | 桔梗流注膏 |
TCMH1584 | Achyranthes bidentata | Niu Teng | 牛藤 |
Ingredient ID: TCMC1786
Formula: C30H48O3
Common Name | Oleanolic_Acid |
IUPAC Name | (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-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]1CC[C@]2([C@H](C1(C)C)CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC(C)(C)CC1)C(=O)O)C)C |
Standard InCHI | InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23-,27-,28+,29+,30-/m0/s1 |
Standard InCHIKey | MIJYXULNPSFWEK-GTOFXWBISA-N |
External Identifiers | ChEMBL [CHEMBL168]; PubChem [10494]; |
Reference of Component-Ingredient Pair | 22002744 |
Component ID | Latin Name | Pinyin Name | Chinese Name |
---|---|---|---|
TCMH1000 | Foeniculum vulgare | Hui Xiang | 茴香 |
TCMH1008 | Pogostemon cablin | Huo Xiang | 藿香 |
TCMH1009 | Pogostemon cablin | Huo Xiang Ye | 藿香叶 |
TCMH1039 | Kummerowia striata | Ji Yan Cao | 鸡眼草 |
TCMH108 | Perilla frutescens | Bai Su Zi | 白苏子 |
TCMH1080 | Platycodon grandiflorum | Jie Geng | 桔梗 |
TCMH1082 | Platycodon grandiflorum | Jie Geng Gan Gao | 桔梗干膏 |
TCMH1083 | Platycodon grandiflorum | Jie Geng Gan Gao Fen | 桔梗干膏粉 |
TCMH1084 | Platycodon grandiflorum | Jie Geng Liu Jin Gao | 桔梗流浸膏 |
TCMH1085 | Platycodon grandiflorum | Jie Geng Liu Zhu Gao | 桔梗流注膏 |
Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TCMC1786 | C30H48O3 | Oleanolic_Acid | 456.36 | 2.1298 | 4.43 | 9.052 | 3 | 2 | 57.53 | 10 | 5 | 33 | 1 |
TCMC2411 | C30H48O3 | Epi-Oleanolic Acid | 456.36 | 2.1298 | 4.43 | 9.052 | 3 | 2 | 57.53 | 10 | 5 | 33 | 1 |
TCMC2696 | C28H56O2 | N-Octacosanoic Acid | 424.43 | -7.3537 | 4.32 | 14.398 | 2 | 1 | 37.3 | 28 | 0 | 30 | 2 |