 Home > Encyclopedia > [(3S,5R,6R,8S,9S,10R,13S,14S,17R)-17-acetyl-17-acetyloxy-5-chloro-6-hydroxy-10,13-dimethyl-16-methylidene-1,2,3,4,6,7,8,9,11,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

[(3S,5R,6R,8S,9S,10R,13S,14S,17R)-17-acetyl-17-acetyloxy-5-chloro-6-hydroxy-10,13-dimethyl-16-methylidene-1,2,3,4,6,7,8,9,11,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

[(3S,5R,6R,8S,9S,10R,13S,14S,17R)-17-acetyl-17-acetyloxy-5-chloro-6-hydroxy-10,13-dimethyl-16-methylidene-1,2,3,4,6,7,8,9,11,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate structure

CAS No:
118201-17-5
Formula:
C26H37ClO6
Chemical Name:
[(3S,5R,6R,8S,9S,10R,13S,14S,17R)-17-acetyl-17-acetyloxy-5-chloro-6-hydroxy-10,13-dimethyl-16-methylidene-1,2,3,4,6,7,8,9,11,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate
Synonyms:
5 alpha-chloro-16-methylene-3 beta,6 beta,17 alpha-trihydroxypregnan-20-one-3,17-diacetate;5-chloro-16-methylene-3,6,17-trihydroxypregnan-20-one-3,17-diacetate;5-CMTPD;118201-17-5;5-CMTPD;DTXSID50922627;5-Chloro-16-methylene-3,6,17-trihydroxypregnan-20-one-3,17-diacetate;5alpha-Chloro-16-methylene-3beta,6beta,17alpha-trihydroxypregnan-20-one-3,17-diacetate;5-Chloro-6-hydroxy-16-methylidene-20-oxopregnane-3,17-diyl diacetate

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[(3S,5R,6R,8S,9S,10R,13S,14S,17R)-17-acetyl-17-acetyloxy-5-chloro-6-hydroxy-10,13-dimethyl-16-methylidene-1,2,3,4,6,7,8,9,11,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate Basic Attributes

Molecular Weight：

481.0 g/mol

Exact Mass：

480.2278666 g/mol

Characteristics

PSA：

89.9 Å²

Drug Information

MeSH Entry Terms：

5 alpha-chloro-16-methylene-3 beta,6 beta,17 alpha-trihydroxypregnan-20-one-3,17-diacetate

Computed Properties

Molecular Weight:481.0
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:480.2278666
Monoisotopic Mass:480.2278666
Topological Polar Surface Area:89.9
Heavy Atom Count:33
Complexity:901
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [(3S,5R,6R,8S,9S,10R,13S,14S,17R)-17-acetyl-17-acetyloxy-5-chloro-6-hydroxy-10,13-dimethyl-16-methylidene-1,2,3,4,6,7,8,9,11,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

Basic Attributes
Characteristics
Drug Information
Computed Properties
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