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(3R,5S,7R,8R,9S,10S,13S,14S,17R)-10,13-dimethyl-17-[(Z)-1-methylprop-1-enyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
SpectraBase Compound ID zZOP6FnehC
InChI InChI=1S/C23H38O2/c1-5-14(2)17-6-7-18-21-19(9-11-23(17,18)4)22(3)10-8-16(24)12-15(22)13-20(21)25/h5,15-21,24-25H,6-13H2,1-4H3/b14-5-/t15-,16+,17+,18-,19-,20+,21-,22-,23+/m0/s1
InChIKey QNINQDIUVAIBOX-PIUJJTOUSA-N
Mol Weight 346.6 g/mol
Molecular Formula C23H38O2
Exact Mass 346.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ec6bB7T3FU
Name (3R,5S,7R,8R,9S,10S,13S,14S,17R)-10,13-dimethyl-17-[(Z)-1-methylprop-1-enyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
CAS Registry Number 109361-96-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H38O2
InChI InChI=1S/C23H38O2/c1-5-14(2)17-6-7-18-21-19(9-11-23(17,18)4)22(3)10-8-16(24)12-15(22)13-20(21)25/h5,15-21,24-25H,6-13H2,1-4H3/b14-5-/t15-,16+,17+,18-,19-,20+,21-,22-,23+/m0/s1
InChIKey QNINQDIUVAIBOX-PIUJJTOUSA-N
Molecular Weight 346.555 g/mol
SMILES O[C@]1(C[C@@]2([C@@]([C@]3(CC[C@]4([C@]([C@@]3([C@@](C2)(O)[H])[H])(CC[C@@]4(\C(=C/C)C)[H])[H])C)[H])(CC1)C)[H])[H]
SPLASH splash10-000j-7009000000-1bc3688ea9bdbbbbbff7
Source of Spectrum H-69-1848-3
Synonyms (3R,5S,7R,8R,9S,10S,13S,14S,17R)-17-[(Z)-but-2-en-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
Wiley ID 1339735