1β-Hydroxycholic acid
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1β-Hydroxycholic acid
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CAS No:
80875-94-1
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Formula:
C24H40O6
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Chemical Name:
1β-Hydroxycholic acid
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Synonyms:
Cholan-24-oic acid,1,3,7,12-tetrahydroxy-,(1β,3α,5β,7α,12α)-;(1β,3α,5β,7α,12α)-1,3,7,12-Tetrahydroxycholan-24-oic acid;1β-Hydroxycholic acid;1β,3α,7α,12α-Tetrahydroxy-5β-cholanoic acid;1β,3α,7α,12α-Tetrahydroxy-5β-cholan-24-oic acid
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CAS No:
1β-Hydroxycholic acid Use and Manufacturing
Lipids -> Sterol Lipids [ST] -> Bile acids and derivatives [ST04] -> C24 bile acids, alcohols, and derivatives [ST0401]
Computed Properties
Molecular Weight:424.6
XLogP3:2.6
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:424.28248899
Monoisotopic Mass:424.28248899
Topological Polar Surface Area:118
Heavy Atom Count:30
Complexity:668
Defined Atom Stereocenter Count:12
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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