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Basic information
- Standard SMILES
CC(=O)OCC(=O)C12OC1CC1C3CCC4CC(=O)CCC4(C)C3CC(=O)C12C- InChIKey
RWXXVDGCRIMAQJ-UHFFFAOYSA-N- Molecular formula
- C23H30O6
- Average molar mass
- 402.5 g/mol
- Monoisotopic mass
- 402.20423867
Names & identifiers
- Preferred name
- [2-(7,11-Dimethyl-8,14-dioxo-5-oxapentacyclo[8.8.0.02,7.04,6.011,16]octadecan-6-yl)-2-oxoethyl] acetate
- IUPAC
- [2-(7,11-dimethyl-8,14-dioxo-5-oxapentacyclo[8.8.0.02,7.04,6.011,16]octadecan-6-yl)-2-oxoethyl] acetate
Names & synonyms
NSC192731NSC-192731
Database identifiers
- PubChem CID
- 303604
Properties
Computed structural propertiesFilling in
- XLogP
- 1.8
- Topological polar surface area
- 90 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 818
Related reactions
0 records
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Compound notes
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