7α-Hydroxy-3-oxo-4-cholestenoic acid
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7α-Hydroxy-3-oxo-4-cholestenoic acid
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CAS No:
115538-85-7
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Formula:
C27H42O4
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Chemical Name:
7α-Hydroxy-3-oxo-4-cholestenoic acid
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Synonyms:
Cholest-4-en-26-oic acid,7-hydroxy-3-oxo-,(7α)-;(7α)-7-Hydroxy-3-oxocholest-4-en-26-oic acid;7α-Hydroxy-3-oxo-4-cholestenoic acid;7α-Hydroxy-3-oxocholest-4-en-26-oic acid
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CAS No:
Description
ChEBI: A cholestanoid that is cholest-4-en-26-oic acid substituted by an alpha-hydroxy group at position 7 and an oxo group at position 3. It is an intermediate metabolite in the bile acid synthesis.
Solid
7alpha-hydroxy-3-oxo-4-cholestenoic acid is a cholestanoid that is cholest-4-en-26-oic acid substituted by an alpha-hydroxy group at position 7 and an oxo group at position 3. It is an intermediate metabolite in the bile acid synthesis. It has a role as a human metabolite. It is a 3-oxo-Delta(4) steroid, a 7alpha-hydroxy steroid, a cholestanoid, a steroid acid and a monocarboxylic acid. It is a conjugate acid of a 7alpha-hydroxy-3-oxo-4-cholestenoate.
Computed Properties
Molecular Weight:430.6
XLogP3:5.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:430.30830982
Monoisotopic Mass:430.30830982
Topological Polar Surface Area:74.6
Heavy Atom Count:31
Complexity:756
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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7α-Hydroxy-3-oxo-4-cholestenoic acid
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