(8R,9S,10R,13S,14S,17R)-6,17-dihydroxy-17-(1-hydroxyethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
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![(8R,9S,10R,13S,14S,17R)-6,17-dihydroxy-17-(1-hydroxyethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f30fc921ad8c48deaee3abc810d8a014.png "(8R,9S,10R,13S,14S,17R)-6,17-dihydroxy-17-(1-hydroxyethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one")
(8R,9S,10R,13S,14S,17R)-6,17-dihydroxy-17-(1-hydroxyethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
structure -
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CAS No:
105248-42-8
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Formula:
C21H32O4
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Chemical Name:
(8R,9S,10R,13S,14S,17R)-6,17-dihydroxy-17-(1-hydroxyethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
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Synonyms:
6,17,20-trihydroxypregn-4-ene-3-one;6,17-20-THPO;6beta,17,20alpha-trihydroxypregn-4-ene-3-one;105248-42-8;SCHEMBL142062;DTXSID30909395;6,17,20-trihydroxypregn-4-en-3-one;(8R,9S,10R,13S,14S,17R)-6,17-dihydroxy-17-(1-hydroxyethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
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CAS No:
(8R,9S,10R,13S,14S,17R)-6,17-dihydroxy-17-(1-hydroxyethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one Basic Attributes
348.5 g/mol
348.23005950 g/mol
Computed Properties
Molecular Weight:348.5
XLogP3:1.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:348.23005950
Monoisotopic Mass:348.23005950
Topological Polar Surface Area:77.8
Heavy Atom Count:25
Complexity:627
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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