Basic information
- Standard SMILES
CC(C)[C@@]12CC[C@]3(C)C=CC(C=O)=CC[C@]31O2- InChIKey
GHUAFOWOMHKWSH-KKUMJFAQSA-N- Molecular formula
- C15H20O2
- Average molar mass
- 232.32 g/mol
- Monoisotopic mass
- 232.14632988
Names & identifiers
- Preferred name
- (1S,7R,10S)-7-methyl-10-propan-2-yl-11-oxatricyclo[5.4.0.01,10]undeca-3,5-diene-4-carbaldehyde
- IUPAC
- (1S,7R,10S)-7-methyl-10-propan-2-yl-11-oxatricyclo[5.4.0.01,10]undeca-3,5-diene-4-carbaldehyde
Database identifiers
- Nikkaji
- J448.195J
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 29.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 434
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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