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广藿香
Guang Huo Xiang / Herba Pogostemonis; Pogostemonis Herba
Guang Huo XiangHerba Pogostemonis; Pogostemonis Herba
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 4
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Trihydroxybufosterocholanic acid
- Molecular Formula
- C28H48O5
- Molecular Weight
- No data
- Canonical SMILES
- CC(CCC(C)C(C)C(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
- Isomeric SMILES
- CC(CCC(C)C(C)C(=O)O)C1CCC2[C@@]1(C(CC3C2C(C[C@H]4[C@@]3(CCC(C4)O)C)O)O)C
- InChI
- InChI=1S/C28H48O5/c1-15(17(3)26(32)33)6-7-16(2)20-8-9-21-25-22(14-24(31)28(20,21)5)27(4)11-10-19(29)12-18(27)13-23(25)30/h15-25,29-31H,6-14H2,1-5H3,(H,32,33)/t15?,16?,17?,18-,19?,20?,21?,22?,23?,24?,25?,27-,28+/m0/s1
- Oral Bioavailability
- 16.781
- Drug Likeness
- 0.456
- DL Score
- No data
- Caco-2 Permeability
- No data
- ALogP
- No data
- Bioavailability Score
- No data
Identifiers
- InChI Key
- No data
- PubChem CID
- No data
Description and Extensions
- Toxicity Information
- No data
Related
Related Entities
Direct relations and traceable candidates grouped by relation type.