 Home > Encyclopedia > [2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 1-hydroxy-2,2,5,5-tetramethylpyrrole-3-carboxylate

[2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 1-hydroxy-2,2,5,5-tetramethylpyrrole-3-carboxylate

[2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 1-hydroxy-2,2,5,5-tetramethylpyrrole-3-carboxylate structure

CAS No:
69081-49-8
Formula:
C30H43NO5
Chemical Name:
[2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 1-hydroxy-2,2,5,5-tetramethylpyrrole-3-carboxylate
Synonyms:
deoxycorticosterone nitroxide;desoxycorticosterone nitroxide;69081-49-8;Deoxycorticosterone nitroxide;Desoxycorticosterone nitroxide;3,20-dioxopregn-4-en-21-yl 1-hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1h-pyrrole-3-carboxylate;DTXSID70988801;Pregn-4-ene-3,20-dione, 21-(((2,5-dihydro-2,2,5,5-tetramethyl-1-oxy-1H-pyrrol-3-yl)carbonyl)oxy)-

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[2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 1-hydroxy-2,2,5,5-tetramethylpyrrole-3-carboxylate Basic Attributes

Molecular Weight：

497.7 g/mol

Exact Mass：

497.31412347 g/mol

Characteristics

PSA：

83.9 Å²

Drug Information

MeSH Entry Terms：

deoxycorticosterone nitroxide

Computed Properties

Molecular Weight:497.7
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:497.31412347
Monoisotopic Mass:497.31412347
Topological Polar Surface Area:83.9
Heavy Atom Count:36
Complexity:1050
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 1-hydroxy-2,2,5,5-tetramethylpyrrole-3-carboxylate

Basic Attributes
Characteristics
Drug Information
Computed Properties
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