6,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
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6,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
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CAS No:
548-97-0
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Formula:
C21H30O5
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Chemical Name:
6,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
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Synonyms:
6,17,21-trihydroxypregn-4-ene-3,20-dione;MLS002638102;548-97-0;NSC9733;6,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one;CHEMBL1870018;DTXSID10970149;HMS3086B03;NSC-9733;MCULE-5480996294;SMR001547595
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CAS No:
6,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one Basic Attributes
362.5 g/mol
362.20932405 g/mol
9733
Computed Properties
Molecular Weight:362.5
XLogP3:1.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:362.20932405
Monoisotopic Mass:362.20932405
Topological Polar Surface Area:94.8
Heavy Atom Count:26
Complexity:684
Undefined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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