Basic information
- Standard SMILES
CC(C)=CCC[C@@H](C)[C@H]1CC=C2C3=C(CC[C@@]21C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3- InChIKey
YBFCFMATWHTIGL-SRSKCPMFSA-N- Molecular formula
- C29H44O
- Average molar mass
- 408.7 g/mol
Names & identifiers
- Preferred name
- 4,4-Di methyl-5alpha-cholesta-8,14,24-trien-3-one
- IUPAC
- (5R,10S,13R,17R)-4,4,10,13-tetramethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,5,6,7,11,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-one
Names & synonyms
SCHEMBL7258172YBFCFMATWHTIGL-SRSKCPMFSA-N4,4-di methyl-5alpha-cholesta-8,14,24-trien-3-one4,4-dimethyl-5alpha-cholesta-8,14,24-trien-3-one
Database identifiers
- PubChem CID
- 70037746
Properties
Computed structural properties
- XLogP
- 7.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 817
Related reactions
1 records
Compound notes
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