 Home > Encyclopedia > 1-[(3S,8R,9S,10R,13S,14S,16R)-3,14,16,17-tetrahydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone

1-[(3S,8R,9S,10R,13S,14S,16R)-3,14,16,17-tetrahydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone

1-[(3S,8R,9S,10R,13S,14S,16R)-3,14,16,17-tetrahydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone structure

CAS No:
111625-60-6
Formula:
C21H32O5
Chemical Name:
1-[(3S,8R,9S,10R,13S,14S,16R)-3,14,16,17-tetrahydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
Synonyms:
DTXSID10912241;111625-60-6;3,14,16,17-tetrahydroxypregn-5-en-20-one

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1-[(3S,8R,9S,10R,13S,14S,16R)-3,14,16,17-tetrahydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone Basic Attributes

Molecular Weight：

364.5 g/mol

Exact Mass：

364.22497412 g/mol

Characteristics

PSA：

98 Å²

Computed Properties

Molecular Weight:364.5
XLogP3:1.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:364.22497412
Monoisotopic Mass:364.22497412
Topological Polar Surface Area:98
Heavy Atom Count:26
Complexity:673
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[(3S,8R,9S,10R,13S,14S,16R)-3,14,16,17-tetrahydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone

Basic Attributes
Characteristics
Computed Properties

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