 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] 4-bromobenzenesulfonate

[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] 4-bromobenzenesulfonate

[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] 4-bromobenzenesulfonate structure

CAS No:
21170-34-3
Formula:
C27H33BrO5S
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] 4-bromobenzenesulfonate
Synonyms:
4-pregnen-21-ol-3,20-dione-21-(4-bromobenzenesufonate);NSC 88915;NSC-88915;NSC88915;21170-34-3;3,20-dioxopregn-4-en-21-yl 4-bromobenzenesulfonate;NSC88915;CHEMBL387152;NSC-88915;NSC-8891;3,20-Dioxopregn-4-en-21-yl 4-bromobenzenesulfonate; [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] 4-bromobenzenesulfonate;UNII-J6CZ92K8RU;J6CZ92K8RU;SCHEMBL13856957;DTXSID40943503;Pregn-4-ene-3,20-dione, 21-[[(4-bromophenyl)sulfonyl]oxy]-;ZINC4901407;BDBM50158383;NCI60_041972;170D343;3,20-Dioxopregn-4-en-21-yl 4-bromobenzene-1-sulfonate;4-pregnen-21-ol-3,20-dione-21-(4-bromobenzenesufonate);2-((8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl 4-bromobenzenesulfonate

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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] 4-bromobenzenesulfonate Basic Attributes

Molecular Weight：

549.5 g/mol

Exact Mass：

548.12321 g/mol

UNII：

J6CZ92K8RU

NSC Number：

88915

Characteristics

PSA：

85.9 Å²

Drug Information

MeSH Entry Terms：

4-pregnen-21-ol-3,20-dione-21-(4-bromobenzenesufonate)

Computed Properties

Molecular Weight:549.5
XLogP3:5.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:548.12321
Monoisotopic Mass:548.12321
Topological Polar Surface Area:85.9
Heavy Atom Count:34
Complexity:976
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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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] 2-bromoacetate

36049-51-1
2-(4-ETHOXYPHENYL)-4-OXO-4H-CHROMEN-3-YL 4-BROMOBENZENESULFONATE

298217-83-1
4-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]METHYL)PHENYL 4-BROMOBENZENESULFONATE

338416-31-2
2,2-Dimethylpropyl 4-bromobenzenesulfonate Formula

14248-15-8
(2,4-dichlorophenyl) 4-bromobenzenesulfonate Formula

104996-92-1
(2,5-dimethylphenyl) 4-bromobenzenesulfonate Formula

433971-03-0
4-chloro-2-(morpholin-4-ylcarbothioyl)phenyl 4-bromobenzenesulfonate Structure

496769-26-7
3-(2-bicyclo[2.2.1]hept-5-enyl)propyl 4-bromobenzenesulfonate Structure

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What is 3-tricyclo[2.2.1.02,6]heptanylmethyl 4-bromobenzenesulfonate

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What is 2-bicyclo[2.2.2]octanylmethyl 4-bromobenzenesulfonate

40500-82-1

Hot Searches: methyl acetate; stroke lacunar infarct; cyclobutane; hydrogen sulphide formula; bioglutide; tetrasodium pyrophosphate

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] 4-bromobenzenesulfonate

Basic Attributes
Characteristics
Drug Information
Computed Properties
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