Ethyl (5β)-3,7,12-trioxocholan-24-oate
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Ethyl (5β)-3,7,12-trioxocholan-24-oate
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CAS No:
52718-49-7
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Formula:
C26H38O5
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Chemical Name:
Ethyl (5β)-3,7,12-trioxocholan-24-oate
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Synonyms:
Cholan-24-oic acid,3,7,12-trioxo-,ethyl ester,(5β)-;Dehydrocholic acid,ethyl ester;Ethyl (5β)-3,7,12-trioxocholan-24-oate;Ethyl 3,7,12-triketo-5β-cholanate;Ethyl 3,7,12-trioxo-5β-cholan-24-oate
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CAS No:
Computed Properties
Molecular Weight:430.6
XLogP3:3.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:430.27192431
Monoisotopic Mass:430.27192431
Topological Polar Surface Area:77.5
Heavy Atom Count:31
Complexity:787
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Ethyl (5β)-3,7,12-trioxocholan-24-oate
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