2-[(8R,9S,10R,13S,14S,15R,17S)-17-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-15-yl]acetic acid
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![2-[(8R,9S,10R,13S,14S,15R,17S)-17-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-15-yl]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7fa8fa6a05f64881ba3138d9ed4623fa.png "2-[(8R,9S,10R,13S,14S,15R,17S)-17-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-15-yl]acetic acid")
2-[(8R,9S,10R,13S,14S,15R,17S)-17-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-15-yl]acetic acid
structure -
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CAS No:
65423-15-6
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Formula:
C21H30O4
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Chemical Name:
2-[(8R,9S,10R,13S,14S,15R,17S)-17-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-15-yl]acetic acid
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Synonyms:
15-carboxymethyltestosterone;15alpha-CMT;15beta-CMT;65423-15-6;2-[(8R,9S,10R,13S,14S,15R,17S)-17-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-15-yl]acetic acid;15-Carboxymethyltestosterone;15alpha-Cmt;15beta-Cmt;SCHEMBL6026531;DTXSID00984038;A835910;(17-Hydroxy-3-oxoandrost-4-en-15-yl)acetic acid;17beta-Hydroxy-3-oxoandrost-4-ene-15alpha-acetic acid;Androst-4-ene-15-acetic acid, 17-hydroxy-3-oxo-, (15alpha,17beta)-;2-[(8R,9S,10R,13S,14S,15R,17S)-10,13-dimethyl-17-oxidanyl-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-15-yl]ethanoic acid
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CAS No:
2-[(8R,9S,10R,13S,14S,15R,17S)-17-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-15-yl]acetic acid Basic Attributes
346.5 g/mol
346.21440943 g/mol
Computed Properties
Molecular Weight:346.5
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:346.21440943
Monoisotopic Mass:346.21440943
Topological Polar Surface Area:74.6
Heavy Atom Count:25
Complexity:638
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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