01
苦参
Ku Shen / Radix Sophorae Flavescentis; Sophorae Flavescentis Radix
Ku ShenRadix Sophorae Flavescentis; Sophorae Flavescentis Radix
Ingredients
(2r)-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2s)-2-isopropenyl-5-methylhex-4-enyl]-4-chromanone
C25H28O6
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 8
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (2r)-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2s)-2-isopropenyl-5-methylhex-4-enyl]-4-chromanone
- Molecular Formula
- C25H28O6
- Molecular Weight
- No data
- Canonical SMILES
- CC(=CCC(CC1=C2C(=C(C=C1O)O)C(=O)CC(O2)C3=C(C=C(C=C3)O)O)C(=C)C)C
- Isomeric SMILES
- CC(=CC[C@@H](CC1=C2C(=C(C=C1O)O)C(=O)C[C@@H](O2)C3=C(C=C(C=C3)O)O)C(=C)C)C
- InChI
- InChI=1S/C25H28O6/c1-13(2)5-6-15(14(3)4)9-18-20(28)11-21(29)24-22(30)12-23(31-25(18)24)17-8-7-16(26)10-19(17)27/h5,7-8,10-11,15,23,26-29H,3,6,9,12H2,1-2,4H3/t15-,23+/m0/s1
- Oral Bioavailability
- 1.220
- Drug Likeness
- 0.468
- 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.
Source Herbs
herb ingredient1 Herbs