4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
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![4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6ecc2e1d01e947c1a86c65662cbe6790.png "4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid")
4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
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CAS No:
30635-00-8
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Formula:
C24H40O4
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Chemical Name:
4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
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Synonyms:
Cholan-24-oic acid, 3,12-dihydroxy-, (3.alpha.,5.beta.,12.alpha.)-;4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid;30635-00-8;SCHEMBL2735036;DTXSID30274393;BCP15620;3,12-Dihydroxycholan-24-oic acid;NSC224323;AKOS002391126;MCULE-3393759799;NSC-224323;LS-15078;DS-005041;3BETA,12ALPHA-DIHYDROXYCHOLANIC ACID;FT-0665783;N1669;Deoxycholate;Cholanoic Acid; Desoxycholic acid;L000718;3-ALPHA,12-BETA-DIHYDROXY-5-BETA-CHOLAN-24-OIC ACID;3??,12??-Dihydroxy-5??-cholanic acid, 7-Deoxycholic acidl
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CAS No:
4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid Basic Attributes
392.6 g/mol
392.29265975 g/mol
224323
DTXSID30274393
4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid Use and Manufacturing
Cholan-24-oic acid, 3,12-dihydroxy-, (3.alpha.,5.beta.,12.alpha.)-: ACTIVE
Computed Properties
Molecular Weight:392.6
XLogP3:4.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:392.29265975
Monoisotopic Mass:392.29265975
Topological Polar Surface Area:77.8
Heavy Atom Count:28
Complexity:605
Undefined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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