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Stigmasta-5,22-dien-4-ol, 3-methoxy-, (3.beta.,4.beta.,22E,24R)-
SpectraBase Compound ID JSH1vjhyuGX
InChI InChI=1S/C30H50O2/c1-8-21(19(2)3)10-9-20(4)23-13-14-24-22-11-12-26-28(31)27(32-7)16-18-30(26,6)25(22)15-17-29(23,24)5/h9-10,12,19-25,27-28,31H,8,11,13-18H2,1-7H3/b10-9+/t20-,21+,22+,23-,24+,25+,27+,28-,29-,30-/m1/s1
InChIKey AXUYQSZHMRPADX-QUTKLCSDSA-N
Mol Weight 442.7 g/mol
Molecular Formula C30H50O2
Exact Mass 442.381081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzddimGhQA4
Name Stigmasta-5,22-dien-4-ol, 3-methoxy-, (3.beta.,4.beta.,22E,24R)-
Alternate Name(s) (3beta,4beta,22E,24R)-3-methoxystigmasta-5,22-dien-4-ol
CAS Registry Number 65527-26-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O2
InChI InChI=1S/C30H50O2/c1-8-21(19(2)3)10-9-20(4)23-13-14-24-22-11-12-26-28(31)27(32-7)16-18-30(26,6)25(22)15-17-29(23,24)5/h9-10,12,19-25,27-28,31H,8,11,13-18H2,1-7H3/b10-9+/t20-,21+,22+,23-,24+,25+,27+,28-,29-,30-/m1/s1
InChIKey AXUYQSZHMRPADX-QUTKLCSDSA-N
Molecular Weight 442.728 g/mol
SMILES O[C@@]1(C=2[C@@]([C@@]3([C@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](\C=C\[C@@](C(C)C)(CC)[H])(C)[H])[H])[H])(CC2)[H])[H])(CC[C@@]1(OC)[H])C)[H]
SPLASH splash10-01ox-0012900000-296c16e53048309ec5fb
Source of Spectrum W5-0-0-0
Wiley ID 1385577