01
大黄
Da Huang / Radix et Rhizoma Rhei; Rhei Radix et Rhizoma
Da HuangRadix et Rhizoma Rhei; Rhei Radix et Rhizoma
Ingredients
10beta-hydroxy-6beta-isobutyrylfuranoeremophilane
C19H28O4
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 10beta-hydroxy-6beta-isobutyrylfuranoeremophilane
- Molecular Formula
- C19H28O4
- Molecular Weight
- No data
- Canonical SMILES
- CC1CCCC2(C1(C(C3=C(C2)OC=C3C)OC(=O)C(C)C)C)O
- Isomeric SMILES
- C[C@H]1CCC[C@]2([C@@]1([C@@H](C3=C(C2)OC=C3C)OC(=O)C(C)C)C)O
- InChI
- InChI=1S/C19H28O4/c1-11(2)17(20)23-16-15-12(3)10-22-14(15)9-19(21)8-6-7-13(4)18(16,19)5/h10-11,13,16,21H,6-9H2,1-5H3/t13-,16+,18-,19-/m0/s1
- Oral Bioavailability
- 16.943
- Drug Likeness
- 0.838
- 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 ingredient2 Herbs