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

1-[(3S,8S,9S,10R,13S,14S,17S)-6-chloro-17-ethyl-3-hydroxy-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone

1-[(3S,8S,9S,10R,13S,14S,17S)-6-chloro-17-ethyl-3-hydroxy-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone structure

CAS No:
3428-91-9
Formula:
C23H33ClO2
Chemical Name:
1-[(3S,8S,9S,10R,13S,14S,17S)-6-chloro-17-ethyl-3-hydroxy-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone
Synonyms:
UNII-OK8NI14GW2;OK8NI14GW2;3428-91-9;(3beta)-6-chloro-17-ethyl-3-hydroxy-pregna-4,6-dien-20-one;BRN 2171434;6-Chloro-17-alpha-ethyl-3-beta-hydroxypregna-4,6-dien-20-one;4,6-Pregnadien-20-one, 6-chloro-17-alpha-ethyl-3-beta-hydroxy-;Pregna-4,6-dien-20-one, 6-chloro-17-alpha-ethyl-3-beta-hydroxy-;DTXSID70955836;Q27896172;1-(6-Chloro-3-hydroxypregna-4,6-dien-17-yl)ethan-1-one;6-Chloro-17alpha-ethyl-3beta-hydroxypregna-4,6-dien-20-one;6-Chloro-17-ethyl-3-hydroxy-pregna-4,6-dien-20-one, (3beta)-

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1-[(3S,8S,9S,10R,13S,14S,17S)-6-chloro-17-ethyl-3-hydroxy-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone Basic Attributes

Molecular Weight：

377.0 g/mol

Exact Mass：

376.2169080 g/mol

UNII：

OK8NI14GW2

Characteristics

PSA：

37.3 Å²

XLogP3：

5.638

Melting Point：

192 - 193 °C

Computed Properties

Molecular Weight:377.0
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:376.2169080
Monoisotopic Mass:376.2169080
Topological Polar Surface Area:37.3
Heavy Atom Count:26
Complexity:694
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[(3S,8S,9S,10R,13S,14S,17S)-6-chloro-17-ethyl-3-hydroxy-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone

Basic Attributes
Characteristics
Computed Properties

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