(5R,8S,9S,10S,11S,13S,14S,17R)-17-acetyl-11,17-dihydroxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
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(5R,8S,9S,10S,11S,13S,14S,17R)-17-acetyl-11,17-dihydroxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
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CAS No:
74263-44-8
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Formula:
C21H32O4
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Chemical Name:
(5R,8S,9S,10S,11S,13S,14S,17R)-17-acetyl-11,17-dihydroxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
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Synonyms:
74263-44-8;NSC9736;DTXSID60995781;NSC-9736;NSC23446;NSC-23446;11,17-dihydroxypregnane-3,20-dione
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CAS No:
(5R,8S,9S,10S,11S,13S,14S,17R)-17-acetyl-11,17-dihydroxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-one Basic Attributes
348.5 g/mol
348.23005950 g/mol
23446|9736
Computed Properties
Molecular Weight:348.5
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:348.23005950
Monoisotopic Mass:348.23005950
Topological Polar Surface Area:74.6
Heavy Atom Count:25
Complexity:615
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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