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CLEROSTEROL;(24-BETA)-STIGMASTA-5,25-DIENOL
SpectraBase Compound ID HMYgQQcaDwQ
InChI InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,20-21,23-27,30H,2,7-9,11-18H2,1,3-6H3/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey GHGKPLPBPGYSOO-VJSFXXLFSA-N
Mol Weight 412.7 g/mol
Molecular Formula C29H48O
Exact Mass 412.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4OTzPxrATgD
Name Clerosterol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H48O
InChI InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,20-21,23-27,30H,2,7-9,11-18H2,1,3-6H3/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey GHGKPLPBPGYSOO-VJSFXXLFSA-N
Literature Reference DOI 10.1002/jccs.201190141
Molecular Weight 412.702 g/mol
SMILES O[C@]1(CC[C@@]2([C@@]3([C@]([C@]4([C@@]([C@@]([C@](C)(CC[C@](C(=C)C)(CC)[H])[H])(CC4)[H])(CC3)C)[H])(CC=C2C1)[H])[H])C)[H]
SPLASH splash10-0a5a-9720100000-0c1892df5a3519f10ea1
Source of Spectrum QA-58-897-7
Synonyms (3S,8S,9S,10R,13R,14S,17R)-17-((2R,5R)-5-ethyl-6-methylhept-6-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
Wiley ID 1796588