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(3.beta.,5.alpha.13.alpha.)-3-(Acetyloxy)-13-hydroxy-18-norandrostan-17-one
SpectraBase Compound ID 6HjJz2j0m6X
InChI InChI=1S/C20H30O4/c1-12(21)24-14-7-9-19(2)13(11-14)3-4-15-16(19)8-10-20(23)17(15)5-6-18(20)22/h13-17,23H,3-11H2,1-2H3/t13-,14-,15+,16-,17-,19-,20-/m0/s1
InChIKey ANMVSMHDEDDPCE-DCHBRCABSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GY4QyWOIqyq
Name (3.beta.,5.alpha.13.alpha.)-3-(Acetyloxy)-13-hydroxy-18-norandrostan-17-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-12(21)24-14-7-9-19(2)13(11-14)3-4-15-16(19)8-10-20(23)17(15)5-6-18(20)22/h13-17,23H,3-11H2,1-2H3/t13-,14-,15+,16-,17-,19-,20-/m0/s1
InChIKey ANMVSMHDEDDPCE-DCHBRCABSA-N
Molecular Weight 334.456 g/mol
SMILES O[C@@]12[C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])[H])(CCC1=O)[H]
SPLASH splash10-001i-0069000000-dcf01a568fef3a3cf8db
Source of Spectrum J-65-3556-8
Synonyms Acetic acid [(3S,5S,8R,9S,10S,13S,14S)-13-hydroxy-10-methyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] ester [(3S,5S,8R,9S,10S,13S,14S)-13-hydroxy-10-methyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate [(3S,5S,8R,9S,10S,13S,14S)-10-methyl-13-oxidanyl-17-oxidanylidene-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] ethanoate
Wiley ID 1532379