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5, 22-Cholestadien-24b-ethyl-3b-ol
SpectraBase Compound ID RCvg3wZ1Rn
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/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey HCXVJBMSMIARIN-PHZDYDNGSA-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 8K03VXeLadv
Name Stigmasterol
Copyright Copyright © 2020-2024 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/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey HCXVJBMSMIARIN-PHZDYDNGSA-N
Ionization Type EI positive ion
Literature Reference DOI 10.1021/acs.jnatprod.5b00858
Molecular Weight 412.702 g/mol
SMILES O[C@]1(CC[C@]2(C(C1)=CC[C@@]1([C@@]2(CC[C@]2([C@]1(CC[C@@]2([C@](C)(\C=C\[C@@](CC)(C(C)C)[H])[H])[H])[H])C)[H])[H])C)[H]
SPLASH splash10-05nf-9610000000-6d21442acb1710317d01
Source of Spectrum G4-79-SM33-3
Wiley ID 1849256