 Home > Encyclopedia > [2-[(8S,9R,10S,11S,13S,14S,17R)-9-chloro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate

[2-[(8S,9R,10S,11S,13S,14S,17R)-9-chloro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate

[2-[(8S,9R,10S,11S,13S,14S,17R)-9-chloro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate structure

CAS No:
29042-01-1
Formula:
C23H31ClO6
Chemical Name:
[2-[(8S,9R,10S,11S,13S,14S,17R)-9-chloro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Synonyms:
9alpha-Chlorocortisol acetate;UNII-N2W994Y9JX;N2W994Y9JX;29042-01-1;9-Chloro-11beta,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate;MLS002638826;9.alpha.-Chlorocortisol acetate;SCHEMBL9277100;CHEBI:79807;NSC21917;ZINC4429266;NSC 21917;NSC-21917;9-Chloro-17-hydroxycorticosterone 21-acetate;C15305;Q27148943;Pregn-4-ene-3, 9-chloro-11.beta.,17,21-trihydroxy-, 21-acetate;Pregn-4-ene-3, 9-chloro-11.beta.,17-21-trihydroxy-, 21-acetate;Pregn-4-ene-3, 21-(acetyloxy)-9-chloro-11,17-dihydroxy-, (11.beta.)-

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Description

9-Chloro-11beta,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate is a corticosteroid hormone.

[2-[(8S,9R,10S,11S,13S,14S,17R)-9-chloro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate Basic Attributes

Molecular Weight：

438.9 g/mol

Exact Mass：

438.1809164 g/mol

UNII：

N2W994Y9JX

NSC Number：

21917

Characteristics

PSA：

101 Å²

Computed Properties

Molecular Weight:438.9
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:438.1809164
Monoisotopic Mass:438.1809164
Topological Polar Surface Area:101
Heavy Atom Count:30
Complexity:838
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-[(8S,9R,10S,11S,13S,14S,17R)-9-chloro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate

Description
Basic Attributes
Characteristics
Computed Properties
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