3α,12α-Diacetoxy-5β-cholan-24-oic acid
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3α,12α-Diacetoxy-5β-cholan-24-oic acid
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CAS No:
33628-48-7
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Formula:
C28H44O6
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Chemical Name:
3α,12α-Diacetoxy-5β-cholan-24-oic acid
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Synonyms:
Deoxycholic acid diacetate;Desoxycholic acid acetated;5.beta.-Cholan-24-oic acid, 3.alpha.,12.alpha.-dihydroxy-, diacetate;7-Desoxycholic acid, diacetate;CHEMBL3589006;Cholan-24-oic acid, 3,12-bis(acetyloxy)-, (3.alpha.,5.beta.,12.alpha.)-;3,12-Bis(acetyloxy)cholan-24-oic acid #;3alpha,12alpha-Diacetoxy-5beta-cholan-24-oic acid
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CAS No:
Computed Properties
Molecular Weight:476.6
XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:476.31378912
Monoisotopic Mass:476.31378912
Topological Polar Surface Area:89.9
Heavy Atom Count:34
Complexity:809
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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