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Home > Encyclopedia > 3β,12α-Dihydroxy-5β-cholanoic acid

3β,12α-Dihydroxy-5β-cholanoic acid

3β,12α-Dihydroxy-5β-cholanoic acid structure

3β,12α-Dihydroxy-5β-cholanoic acid 

structure
  • CAS No:

    570-63-8

  • Formula:

    C24H40O4

  • Chemical Name:

    3β,12α-Dihydroxy-5β-cholanoic acid

  • Synonyms:

    Cholan-24-oic acid,3,12-dihydroxy-,(3β,5β,12α)-;5β-Cholan-24-oic acid,3β,12α-dihydroxy-;5β-Cholanic acid,3β,12α-dihydroxy-;(3β,5β,12α)-3,12-Dihydroxycholan-24-oic acid;3β,12α-Dihydroxycholanoic acid;3β,12α-Dihydroxy-5β-cholan-24-oic acid;3β,12α-Dihydroxy-5β-cholanoic acid;3β-Deoxycholic acid;3β,12α-Dihydroxy-5β-cholanic acid;5β-Cholanic acid-3β,12α-diol;3-Epideoxycholic acid;121571-06-0;42561-42-2

Description

ChEBI: A dihydroxy-5beta-cholanic acid in which the two hydroxy groups are located at positions 3beta and 12alpha. The 3beta-hydroxy epimer of deoxycholic acid.


Solid


3beta,12alpha-dihydroxy-5beta-cholan-24-oic acid is a dihydroxy-5beta-cholanic acid in which the two hydroxy groups are located at positions 3beta and 12alpha. The 3beta-hydroxy epimer of deoxycholic acid. It has a role as a human metabolite. It is a bile acid, a dihydroxy-5beta-cholanic acid, a 12alpha-hydroxy steroid and a 3beta-hydroxy steroid. It is a conjugate acid of a 3beta,12alpha-dihydroxy-5beta-cholan-24-oate.

3β,12α-Dihydroxy-5β-cholanoic acid Basic Attributes

392.58

392.57

XRK5CBU04Y

Characteristics

77.8

4.9

Solid

3β,12α-Dihydroxy-5β-cholanoic acid Use and Manufacturing

Lipids -> Sterol Lipids [ST] -> Bile acids and derivatives [ST04] -> C24 bile acids, alcohols, and derivatives [ST0401]

Computed Properties

Molecular Weight:392.6
XLogP3:4.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:392.29265975
Monoisotopic Mass:392.29265975
Topological Polar Surface Area:77.8
Heavy Atom Count:28
Complexity:605
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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