4-[[(3R,5R,8S,9S,10S,13R,14S,17S)-17-acetyl-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-oxo-butanoic acid

Modify Date: 2025-09-09 19:51:37

4-[[(3R,5R,8S,9S,10S,13R,14S,17S)-17-acetyl-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-oxo-butanoic acid Structure
4-[[(3R,5R,8S,9S,10S,13R,14S,17S)-17-acetyl-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-oxo-butanoic acid structure
Common Name 4-[[(3R,5R,8S,9S,10S,13R,14S,17S)-17-acetyl-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-oxo-butanoic acid
CAS Number 1920-71-4 Molecular Weight 432.55000
Density 1.2g/cm3 Boiling Point 584.4ºC at 760 mmHg
Molecular Formula C25H36O6 Melting Point N/A
MSDS N/A Flash Point 193.5ºC

 Names

Name 4-(((3R,5R,8S,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-11-oxohexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-4-oxobutanoic acid

 Chemical & Physical Properties

Density 1.2g/cm3
Boiling Point 584.4ºC at 760 mmHg
Molecular Formula C25H36O6
Molecular Weight 432.55000
Flash Point 193.5ºC
Exact Mass 432.25100
PSA 97.74000
LogP 4.18990
Vapour Pressure 3.59E-15mmHg at 25°C
Index of Refraction 1.544
InChIKey RKPBFMBKINKTPB-MEFNBDQCSA-N
SMILES CC(=O)C1CCC2C3CCC4CC(OC(=O)CCC(=O)O)CCC4(C)C3C(=O)CC12C
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