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Tirucalla-5,24-dien-3.beta.-ol
SpectraBase Compound ID 3FsfelHMIm9
InChI InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,13,21-24,26,31H,9,11-12,14-19H2,1-8H3/t21-,22-,23-,24+,26-,28+,29-,30+/m0/s1
InChIKey JPIRLIZZOSSGHC-FPLOEHELSA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lug6gyGbIzE
Name Tirucalla-5,24-dien-3.beta.-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,13,21-24,26,31H,9,11-12,14-19H2,1-8H3/t21-,22-,23-,24+,26-,28+,29-,30+/m0/s1
InChIKey JPIRLIZZOSSGHC-FPLOEHELSA-N
Molecular Weight 426.729 g/mol
SMILES O[C@@]1(C(C=2[C@@]([C@]3(CC[C@@]4([C@@]([C@@]3(CC2)[H])(CC[C@]4([C@](CCC=C(C)C)(C)[H])[H])C)C)[H])(CC1)C)(C)C)[H]
SPLASH splash10-014i-9020400000-8b7084b5c15d5ef0e9c8
Source of Spectrum KC-0-2383-1
Synonyms (3beta,13alpha,14beta,17alpha,20S)-lanosta-5,24-dien-3-ol (3S,8R,9S,10R,13S,14R,17S)-4,4,10,13,14-pentamethyl-17-[(2S)-6-methylhept-5-en-2-yl]-2,3,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
Wiley ID 786473