4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid

4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid Structure
CAS No.
2304-89-4
Chemical Name:
4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid
Synonyms
3-Oxocholic acid;3-Ketocholic acid;3-Oxo Deoxycholic Acid;Ursodeoxycholic Acid Impurity 12;7,12-dihydroxy-3-oxocholanic acid;3-Oxo-7α,12α-dihydroxycholanic acid;5β-CHOLANIC ACID-7α, 12α-DIOL-3-ONE;3-Oxo-7α,12α-hydroxy-5β-cholanoic Acid;3-Oxo-7α,12α-hydroxy-5β-cholanoic Acid;3-Oxo-7a,12a-dihydroxy-5b-cholanic acid
CBNumber:
CB71235516
Molecular Formula:
C24H38O5
Molecular Weight:
406.56
MOL File:
2304-89-4.mol
Modify Date:
2023/5/18 11:31:08

4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid Properties

Melting point 185 °C
Boiling point 583.0±50.0 °C(Predicted)
Density 1.180±0.06 g/cm3(Predicted)
storage temp. 2-8°C
solubility Chloroform (Slightly, Heated), Methanol (Slightly)
form Solid
pka 4.76±0.10(Predicted)
color Off-White to Pale Beige
Stability Hygroscopic

SAFETY

Risk and Safety Statements

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P280-P301+P312-P302+P352-P305+P351+P338

4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid Chemical Properties,Uses,Production

Uses

3-Oxo-7α,12α-hydroxy-5β-cholanoic Acid is a keto bile acid derivative.

Definition

ChEBI: A 3-oxo steroid that is cholic acid in which the hydroxy group at position 3 has undergone formal oxidation to the corresponding ketone.

4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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3-Oxocholic acid 4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-te tradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid 7,12-dihydroxy-3-oxocholanic acid 3-Oxo-7α,12α-dihydroxy-5β-cholan-24-oic acid 3-Oxo-7α,12α-dihydroxycholanic acid 7α,12α-Dihydroxy-3-oxo-5β-cholan-24-oic acid 7α,12α-Dihydroxy-3-oxo-5β-cholanic acid 3-Oxo-7α,12α-hydroxy-5β-cholanoic Acid 3-Oxo Deoxycholic Acid 3-Oxo-7a,12a-dihydroxy-5b-cholanic acid 7alpha,12alpha-dihydroxy-3-oxo-5beta-cholan-24-oic acid Ursodeoxycholic Acid Impurity 12 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid (R)-4-((5R,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid 7α,12α-dihydroxy-3-oxo-5β-cholan-24-oicacidmethylester 3-Oxo-7α,12α-hydroxy-5β-cholanoic Acid 7α,12α-dihydroxy-3-oxo-5β-cholan-24-oic acid Cholan-24-oic acid, 7,12-dihydroxy-3-oxo-, (5β,7α,12α)- 5β-CHOLANIC ACID-7α, 12α-DIOL-3-ONE 3-Ketocholic acid 2304-89-4