7,12-diketolithocholic acid

Modify Date: 2025-09-22 17:47:32

7,12-diketolithocholic acid Structure
7,12-diketolithocholic acid structure
Common Name 7,12-diketolithocholic acid
CAS Number 517-33-9 Molecular Weight 404.540
Density 1.2±0.1 g/cm3 Boiling Point 582.2±50.0 °C at 760 mmHg
Molecular Formula C24H36O5 Melting Point N/A
MSDS N/A Flash Point 320.0±26.6 °C

 Names

Name 7,12-dioxolitocholic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 582.2±50.0 °C at 760 mmHg
Molecular Formula C24H36O5
Molecular Weight 404.540
Flash Point 320.0±26.6 °C
Exact Mass 404.256287
PSA 91.67000
LogP 2.22
Vapour Pressure 0.0±3.7 mmHg at 25°C
Index of Refraction 1.543
InChIKey MAFJMPFLJJCSTB-FQBQTYDJSA-N
SMILES CC(CCC(=O)O)C1CCC2C3C(=O)CC4CC(O)CCC4(C)C3CC(=O)C12C
Storage condition 2-8°C

 Synonyms

3α-hydroxy-7,12-dioxo-5β-cholanoic-24 acid
3α-hydroxy-7,12-dioxo-5β-cholane-24-oic acid
7,12-dioxo-lithocholic acid
3α-hydroxy-7,12-diketo-5β-cholan-24-oic acid
3α-hydroxy-7,12-dioxo-5β-cholan-24-oic acid
(R)-4-((3R,5S,8R,9S,10S,13R,14S,17R)-3-Hydroxy-10,13-dimethyl-7,12-dioxo-hexadecahydro-cyclopenta[a]phenanthren-17-yl)-pentanoic acid
(3α,5β)-3-Hydroxy-7,12-dioxocholan-24-oic acid
7,12-diketolithocholic acid
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