(5α,7β)-7-Hydroxy-3-oxocholan-24-oic acid
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(5α,7β)-7-Hydroxy-3-oxocholan-24-oic acid
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CAS No:
77059-13-3
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Formula:
C24H38O4
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Chemical Name:
(5α,7β)-7-Hydroxy-3-oxocholan-24-oic acid
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Synonyms:
Cholan-24-oic acid,7-hydroxy-3-oxo-,(5α,7β)-;(5α,7β)-7-Hydroxy-3-oxocholan-24-oic acid
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CAS No:
Description
7beta-hydroxy-3-oxo-5alpha-cholan-24-oic acid is a bile acid that is 5alpha-cholan-24-oic acid carrying an oxo group at position 3 and a hydroxy group at position 7beta. It is a bile acid, a 3-oxo-5alpha-steroid, a 7beta-hydroxy steroid and a member of 5alpha-cholanic acids.
Computed Properties
Molecular Weight:390.6
XLogP3:4.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:390.27700969
Monoisotopic Mass:390.27700969
Topological Polar Surface Area:74.6
Heavy Atom Count:28
Complexity:645
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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