[(3S,9R,10R,13S,14S,17R)-17-[(2S,3S,5R)-5-[(2R)-3,3-dimethyloxiran-2-yl]-2-hydroxyoxolan-3-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
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[(3S,9R,10R,13S,14S,17R)-17-[(2S,3S,5R)-5-[(2R)-3,3-dimethyloxiran-2-yl]-2-hydroxyoxolan-3-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
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CAS No:
22046-06-6
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Formula:
C32H50O5
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Chemical Name:
[(3S,9R,10R,13S,14S,17R)-17-[(2S,3S,5R)-5-[(2R)-3,3-dimethyloxiran-2-yl]-2-hydroxyoxolan-3-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
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Synonyms:
Aphanamixin;22046-06-6;13alpha,14beta,17betaH-Lanost-7-ene-3beta,21-diol, 21,23:24,25-diepoxy-, 3-acetate, (20S,21S,23R,24R)-
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CAS No:
[(3S,9R,10R,13S,14S,17R)-17-[(2S,3S,5R)-5-[(2R)-3,3-dimethyloxiran-2-yl]-2-hydroxyoxolan-3-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate Basic Attributes
514.7 g/mol
514.36582469 g/mol
Computed Properties
Molecular Weight:514.7
XLogP3:6.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:514.36582469
Monoisotopic Mass:514.36582469
Topological Polar Surface Area:68.3
Heavy Atom Count:37
Complexity:999
Defined Atom Stereocenter Count:10
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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