Phyllocladan-16alpha-ol
Basic information
- Standard SMILES
CC1(C)CCC[C@@]2(C)C1CC[C@@]13C[C@@H](CCC12)[C@](C)(O)C3- InChIKey
FZSRMADKTOBCNT-WLAIHKBOSA-N- Molecular formula
- C20H34O
- Average molar mass
- 290.5 g/mol
- Monoisotopic mass
- 290.2609657
Names & identifiers
- Preferred name
- Phyllocladan-16alpha-ol
- IUPAC
- (1S,9S,13R,14R)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,9]hexadecan-14-ol
Names & synonyms
phyllocladanolphyllocladan-16alpha-olent-16-a-hydroxy-kaureneSCHEMBL30111361FZSRMADKTOBCNT-WLAIHKBOSA-NDTXSID001358610Q67880051
Database identifiers
- PubChem CID
- 44237348
- DTXSID
DTXSID001358610
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 455
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…