Basic information
- Standard SMILES
COc1ccc2c(c1)CCC1C2=CCC2(C)C(=O)CCC12- InChIKey
AGAVSENPCRLEAB-UHFFFAOYSA-N- Molecular formula
- C19H22O2
- Average molar mass
- 282.4 g/mol
Names & identifiers
- Preferred name
- 3-methoxy-13-methyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one
- IUPAC
- 3-methoxy-13-methyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one
Names & synonyms
FM181955
Database identifiers
- PubChem CID
- 624778
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 480
Related reactions
1 records
Compound notes
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