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Basic information
- CAS
4248-04-8- Standard SMILES
COc1ccc2c(c1)CC[C@H]1[C@@H]3CCC(=O)[C@@H]3CC[C@H]21- InChIKey
GDDDQTOBTQTTJD-WCXIOVBPSA-N- Molecular formula
- C18H22O2
- Average molar mass
- 270.37 g/mol
Names & identifiers
- Preferred name
- (8R,9S,13R,14R)-3-methoxy-6,7,8,9,11,12,13,14,15,16-decahydrocyclopenta[a]phenanthren-17-one
- English name
- (8R,9S,13R,14R)-3-methoxy-6,7,8,9,11,12,13,14,15,16-decahydrocyclopenta[a]phenanthren-17-one
- Molecular formula
- C18H22O2
- Molecular weight
- 270.37
Names & synonyms
(13α)-3-Methoxy-1,3,5(10)-gonatrien-17-oneGona-1,3,5(10)-trien-17-one, 3-methoxy-, (13α)- (9CI)(8R,9S,13R,14R)-3-methoxy-6,7,8,9,11,12,13,14,15,16-decahydrocyclopenta[a]phenanthren-17-one
Database identifiers
- CAS
4248-04-8- PubChem CID
- 199481
- Nikkaji
- J140.379F
Properties
Physicochemical properties
- Melting point
- 121 · 121-122 °C(Solvent: Methanol)
- Boiling point
- 429.551 · 429.551±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.113 · 1.113±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Related reactions
0 records
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Compound notes
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