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(1-alpha,5-alpha,7-alpha,17-beta)-7,17-dihydroxy-1-methylandrostane-3-one
SpectraBase Compound ID HfdYuJBBNvP
InChI InChI=1S/C20H32O3/c1-11-8-13(21)9-12-10-16(22)18-14-4-5-17(23)19(14,2)7-6-15(18)20(11,12)3/h11-12,14-18,22-23H,4-10H2,1-3H3/t11-,12+,14-,15-,16+,17-,18-,19-,20-/m0/s1
InChIKey LAUIHEUFEXGUHZ-YOQSSTJXSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BQdKZFnKeLT
Name (1-alpha,5-alpha,7-alpha,17-beta)-7,17-dihydroxy-1-methylandrostane-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-11-8-13(21)9-12-10-16(22)18-14-4-5-17(23)19(14,2)7-6-15(18)20(11,12)3/h11-12,14-18,22-23H,4-10H2,1-3H3/t11-,12+,14-,15-,16+,17-,18-,19-,20-/m0/s1
InChIKey LAUIHEUFEXGUHZ-YOQSSTJXSA-N
Literature Reference DOI 10.1002/cbdv.200590019
Molecular Weight 320.473 g/mol
SMILES O[C@]1([C@]2([C@@]3(CC[C@@]([C@]3(CC[C@@]2([C@]2([C@](CC(C[C@@]2(C1)[H])=O)(C)[H])C)[H])C)(O)[H])[H])[H])[H]
SPLASH splash10-0a4i-9400000000-8b858f5cc5c80f3be08b
Source of Spectrum CBD-2-399-7
Synonyms (1S,5S,7R,8R,9S,10S,13S,14S,17S)-7,17-dihydroxy-1,10,13-trimethylhexadecahydro-3H-cyclopenta[a]phenanthren-3-one
Wiley ID 1792477