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3beta-Hydroxy-16-isobutyliden-delta5-androsten-17-one
SpectraBase Compound ID Ie6XuzWE3s2
InChI InChI=1S/C23H34O2/c1-14(2)11-15-12-20-18-6-5-16-13-17(24)7-9-22(16,3)19(18)8-10-23(20,4)21(15)25/h5,11,14,17-20,24H,6-10,12-13H2,1-4H3/t17-,18+,19-,20-,22-,23-/m0/s1
InChIKey KEZJLVILBWJICT-QPJCPEQFSA-N
Mol Weight 342.5 g/mol
Molecular Formula C23H34O2
Exact Mass 342.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FlHWYjOKuhm
Name 3beta-Hydroxy-16-isobutyliden-delta5-androsten-17-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O2
InChI InChI=1S/C23H34O2/c1-14(2)11-15-12-20-18-6-5-16-13-17(24)7-9-22(16,3)19(18)8-10-23(20,4)21(15)25/h5,11,14,17-20,24H,6-10,12-13H2,1-4H3/t17-,18+,19-,20-,22-,23-/m0/s1
InChIKey KEZJLVILBWJICT-QPJCPEQFSA-N
Literature Reference DOI 10.1002/cber.19681010705
Molecular Weight 342.523 g/mol
SMILES O[C@@]1(CC=2[C@](CC1)([C@@]1([C@@](CC2)([C@]2([C@](CC1)(C(C(C2)=CC(C)C)=O)C)[H])[H])[H])C)[H]
SPLASH splash10-0006-0159000000-6d29c6ac837cf82626eb
Source of Spectrum K-101-2335-13
Synonyms (3S,8R,9S,10R,13S,14S)-3-hydroxy-10,13-dimethyl-16-(2-methylpropylidene)-1,2,3,4,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one
Wiley ID 1793344