(8S,9S,10S,13R,14S,17S)-17-(2-hydroxyacetyl)-10,13-bis(hydroxymethyl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
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![(8S,9S,10S,13R,14S,17S)-17-(2-hydroxyacetyl)-10,13-bis(hydroxymethyl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/853cdc3c1f9b476e856f1794cfc893ca.png "(8S,9S,10S,13R,14S,17S)-17-(2-hydroxyacetyl)-10,13-bis(hydroxymethyl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one")
(8S,9S,10S,13R,14S,17S)-17-(2-hydroxyacetyl)-10,13-bis(hydroxymethyl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
structure -
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CAS No:
84356-52-5
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Formula:
C21H30O5
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Chemical Name:
(8S,9S,10S,13R,14S,17S)-17-(2-hydroxyacetyl)-10,13-bis(hydroxymethyl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
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Synonyms:
18,19-DH-DOCA;18,19-dihydroxydeoxycorticosterone;18,19-dihydroxydesoxycorticosterone;84356-52-5;18,19-Dihydroxydeoxycorticosterone;18,19-DH-Doca;18,19-Dihydroxydesoxycorticosterone;Pregn-4-ene-3,20-dione, 18,19,21-trihydroxy-;DTXSID001004647;18,19,21-trihydroxypregn-4-ene-3,20-dione
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CAS No:
(8S,9S,10S,13R,14S,17S)-17-(2-hydroxyacetyl)-10,13-bis(hydroxymethyl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Basic Attributes
362.5 g/mol
362.20932405 g/mol
Computed Properties
Molecular Weight:362.5
XLogP3:0.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:362.20932405
Monoisotopic Mass:362.20932405
Topological Polar Surface Area:94.8
Heavy Atom Count:26
Complexity:640
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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