Furanestrenone
Basic information
- CAS
52-02-8- Standard SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CCC21CCCO1- InChIKey
UVAQHLGVSKJLTI-CULCCENASA-N- Molecular formula
- C21H30O2
- Average molar mass
- 314.5 g/mol
- Monoisotopic mass
- 314.2245802
Names & identifiers
- Preferred name
- Furanestrenone
- IUPAC
- (8R,9S,10R,13S,14S)-13-methylspiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-oxolane]-3-one
Names & synonyms
FuranestrenoneSC 13664NSC-89030(8R,9S,10R,13S,14S)-13-methylspiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-oxolane]-3-oneNSC89030Spiro[estr-4-ene-17, 4',5'-dihydro-
Database identifiers
- CAS
52-02-8- PubChem CID
- 259283
- Nikkaji
- J3.020.669J
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 564
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Related reactions
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Compound notes
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