 Home > Encyclopedia > 1-[(2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-3-yl]oxy-3,10-dihydrophenoxazin-2-one

1-[(2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-3-yl]oxy-3,10-dihydrophenoxazin-2-one

1-[(2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-3-yl]oxy-3,10-dihydrophenoxazin-2-one structure

CAS No:
135212-24-7
Formula:
C36H47NO4
Chemical Name:
1-[(2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-3-yl]oxy-3,10-dihydrophenoxazin-2-one
Synonyms:
22-((3-oxophenoxazin-7-yl)oxy)-5-cholen-3 beta-ol;22-phenoxazonoxy-5-cholene-3 beta-ol;OPOCHOL;135212-24-7;Opochol;22-Phenoxazonoxy-5-cholene-3beta-ol;22-((3-Oxophenoxazin-7-yl)oxy)-5-cholen-3beta-ol;SCHEMBL9394281;DTXSID90928906;1-[(2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-3-yl]oxy-3,10-dihydrophenoxazin-2-one;1-[(3-Hydroxychol-5-en-22-yl)oxy]-3H-phenoxazin-2(10H)-one

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1-[(2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-3-yl]oxy-3,10-dihydrophenoxazin-2-one Basic Attributes

Molecular Weight：

557.8 g/mol

Exact Mass：

557.35050898 g/mol

Characteristics

PSA：

67.8 Å²

Drug Information

MeSH Entry Terms：

22-((3-oxophenoxazin-7-yl)oxy)-5-cholen-3 beta-ol

Computed Properties

Molecular Weight:557.8
XLogP3:8.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:557.35050898
Monoisotopic Mass:557.35050898
Topological Polar Surface Area:67.8
Heavy Atom Count:41
Complexity:1150
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 3-methylbutanal; chromate charge; acetonide; ischiorectal abscess; teaa; sulfur trioxide

Guide of 1-[(2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-3-yl]oxy-3,10-dihydrophenoxazin-2-one

Basic Attributes
Characteristics
Drug Information
Computed Properties

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