Basic information
- CAS
62251-60-9- Standard SMILES
COC(=O)C1(C)C(OC(C)=O)CC2C3C(CC4CC(OC(C)=O)CCC42C)OC(=O)CC31- InChIKey
XEJSPCGGMGFIEA-UHFFFAOYSA-N- Molecular formula
- C24H34O8
- Average molar mass
- 450.5 g/mol
- Monoisotopic mass
- 450.22536804
Names & identifiers
- Preferred name
- Methyl 5,15-diacetyloxy-2,14-dimethyl-11-oxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadecane-14-carboxylate
- IUPAC
- methyl 5,15-diacetyloxy-2,14-dimethyl-11-oxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadecane-14-carboxylate
Names & synonyms
NSC28746062251-60-9DTXSID50314689NSC-287460Methyl 2,9-bis(acetyloxy)-3,11a-dimethyl-5-oxohexadecahydrophenanthro[10,1-bc]pyran-3-carboxylate
Database identifiers
- CAS
62251-60-9- PubChem CID
- 323969
- DTXSID
DTXSID50314689
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 823
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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