Basic information
- Standard SMILES
COc1ccc2c(c1)CCC1C2CCC2(C)C(O)C=CC12- InChIKey
KAECVEVIXKMEOP-UHFFFAOYSA-N- Molecular formula
- C19H24O2
- Average molar mass
- 284.4 g/mol
Names & identifiers
- Preferred name
- (14S,15S)-5-methoxy-15-methyltetracyclo[8.7.0.0(2),7.0(1)(1),(1)5]heptadeca-2,4,6,12-tetraen-14-ol
- IUPAC
- 3-methoxy-13-methyl-6,7,8,9,11,12,14,17-octahydrocyclopenta[a]phenanthren-17-ol
Names & synonyms
17980-88-0(14S,15S)-5-methoxy-15-methyltetracyclo[8.7.0.0(2),7.0(1)(1),(1)5]heptadeca-2,4,6,12-tetraen-14-olSCHEMBL13557264(14S,15S)-5-Methoxy-15-methyltetracyclo-[8.7.0.0,7.0,5]heptadeca-2,4,6,12-tetraen-14-olSAA98088(14S,15S)-5-Methoxy-15-methyltetracyclo-[8.7.0.0A(2),7.0A(1)A(1),A(1)5]heptadeca-2,4,6,12-tetraen-14-ol
Database identifiers
- PubChem CID
- 625060
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 431
Related reactions
2 records
Compound notes
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