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3,5-Cyclochol-22-en-24-ol, 6-methoxy-, (3.beta.,5.alpha.,6.beta.,22E)-
SpectraBase Compound ID LcXkLkOTX0S
InChI InChI=1S/C25H40O2/c1-16(6-5-13-26)19-7-8-20-18-14-22(27-4)25-15-17(25)9-12-24(25,3)21(18)10-11-23(19,20)2/h5-6,16-22,26H,7-15H2,1-4H3/b6-5+
InChIKey FEDKYGJROLMZTK-AATRIKPKSA-N
Mol Weight 372.6 g/mol
Molecular Formula C25H40O2
Exact Mass 372.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LjVfnX0aJi8
Name 3,5-Cyclochol-22-en-24-ol, 6-methoxy-, (3.beta.,5.alpha.,6.beta.,22E)-
CAS Registry Number 56259-13-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40O2
InChI InChI=1S/C25H40O2/c1-16(6-5-13-26)19-7-8-20-18-14-22(27-4)25-15-17(25)9-12-24(25,3)21(18)10-11-23(19,20)2/h5-6,16-22,26H,7-15H2,1-4H3/b6-5+
InChIKey FEDKYGJROLMZTK-AATRIKPKSA-N
Molecular Weight 372.593 g/mol
SMILES OC\C=C\C(C1CCC2C3CC(OC)C45CC4CCC5(C3CCC12C)C)C
SPLASH splash10-05tf-8928000000-ece0f1e9fa9d16fc276f
Source of Spectrum SD-1981-0-0
Wiley ID 1355860