01
CBX1
No data
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Androsta-1,4-diene-3,17-dione
- Molecular Formula
- C19H24O2
- Molecular Weight
- No data
- Canonical SMILES
- CC12CCC3C(C1CCC2=O)CCC4=CC(=O)C=CC34C
- Isomeric SMILES
- C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)C=C[C@]34C
- InChI
- InChI=1S/C19H24O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,11,14-16H,3-6,8,10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.677
- 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