 Home > Encyclopedia > (1S,2R,6S,11R,12S,16S)-5-hydroxy-2,16-dimethyl-15-oxo-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadec-4-ene-4-carbonitrile

(1S,2R,6S,11R,12S,16S)-5-hydroxy-2,16-dimethyl-15-oxo-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadec-4-ene-4-carbonitrile

(1S,2R,6S,11R,12S,16S)-5-hydroxy-2,16-dimethyl-15-oxo-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadec-4-ene-4-carbonitrile structure

CAS No:
94152-62-2
Formula:
C20H25NO3
Chemical Name:
(1S,2R,6S,11R,12S,16S)-5-hydroxy-2,16-dimethyl-15-oxo-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadec-4-ene-4-carbonitrile
Synonyms:
17-ketotrilostane;17-Ketotrilostane;94152-62-2;DTXSID40916292;3-Hydroxy-17-oxo-4,5-epoxyandrost-2-ene-2-carbonitrile

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(1S,2R,6S,11R,12S,16S)-5-hydroxy-2,16-dimethyl-15-oxo-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadec-4-ene-4-carbonitrile Basic Attributes

Molecular Weight：

327.4 g/mol

Exact Mass：

327.18344366 g/mol

Characteristics

PSA：

73.6 Å²

Drug Information

MeSH Entry Terms：

17-ketotrilostane

Computed Properties

Molecular Weight:327.4
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:327.18344366
Monoisotopic Mass:327.18344366
Topological Polar Surface Area:73.6
Heavy Atom Count:24
Complexity:732
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: tert butyl methyl ether; isobutylene; copper sulphide; furfuryl alcohol; drospirenone-ethinyl estradiol; pyrazole

Guide of (1S,2R,6S,11R,12S,16S)-5-hydroxy-2,16-dimethyl-15-oxo-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadec-4-ene-4-carbonitrile

Basic Attributes
Characteristics
Drug Information
Computed Properties

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