3α-Acetoxy-7,12-dioxo-5β-cholan-24-oicacidmethylester
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3α-Acetoxy-7,12-dioxo-5β-cholan-24-oicacidmethylester
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CAS No:
7753-73-3
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Formula:
C27H40O6
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Chemical Name:
3α-Acetoxy-7,12-dioxo-5β-cholan-24-oicacidmethylester
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Synonyms:
ZINC38347861;Cholan-24-oic acid, 3-(acetyloxy)-7,12-dioxo-, methyl ester, (3.alpha.,5.beta.)-;Methyl 3-(acetyloxy)-7,12-dioxocholan-24-oate #;3alpha-Acetoxy-7,12-dioxo-5beta-cholan-24-oic acid methyl ester
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CAS No:
Computed Properties
Molecular Weight:460.6
XLogP3:3.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:460.28248899
Monoisotopic Mass:460.28248899
Topological Polar Surface Area:86.7
Heavy Atom Count:33
Complexity:835
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3α-Acetoxy-7,12-dioxo-5β-cholan-24-oicacidmethylester
3α-Acetoxy-7,12-dioxo-5β-cholan-24-oicacidmethylester
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