01
川芎
Chuan Xiong / Rhizoma Chuanxiong; Chuanxiong Rhizoma
Chuan XiongRhizoma Chuanxiong; Chuanxiong Rhizoma
Ingredients
(1r,4s,5r)-4-isopropenyl-1,8-dimethylspiro[4.5]dec-8-ene
C15H24
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (1r,4s,5r)-4-isopropenyl-1,8-dimethylspiro[4.5]dec-8-ene
- Molecular Formula
- C15H24
- Molecular Weight
- No data
- Canonical SMILES
- CC1CCC(C12CCC(=CC2)C)C(=C)C
- Isomeric SMILES
- C[C@@H]1CC[C@H]([C@@]12CCC(=CC2)C)C(=C)C
- InChI
- InChI=1S/C15H24/c1-11(2)14-6-5-13(4)15(14)9-7-12(3)8-10-15/h7,13-14H,1,5-6,8-10H2,2-4H3/t13-,14+,15+/m1/s1
- Oral Bioavailability
- 40.007
- Drug Likeness
- 0.542
- 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