2-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid
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![2-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8fa39c753dd74958b0caebaca5b00964.png "2-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid")
2-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid
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CAS No:
58526-32-2
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Formula:
C24H38O4
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Chemical Name:
2-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid
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Synonyms:
58526-32-2;NSC226113;DTXSID40310357;NSC226819;NSC231779;NSC231783;NSC-226113;NSC-226819;NSC-231779;NSC-231783;2-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid;3.beta.-Acetoxy-dinor-5.alpha.-cholanic acid;Pregnane-20-carboxylic acid, (3.beta.,5.alpha.,20S)-
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CAS No:
2-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid Basic Attributes
390.6 g/mol
390.27700969 g/mol
226819|231783|231779|226113
DTXSID40310357
Computed Properties
Molecular Weight:390.6
XLogP3:6.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:390.27700969
Monoisotopic Mass:390.27700969
Topological Polar Surface Area:63.6
Heavy Atom Count:28
Complexity:645
Undefined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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