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ERGOSTERINE
SpectraBase Compound ID 6Yy6CPIVcrp
InChI InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,18-20,22,24-26,29H,11-17H2,1-6H3/b8-7+
InChIKey DNVPQKQSNYMLRS-BQYQJAHWSA-N
Mol Weight 396.7 g/mol
Molecular Formula C28H44O
Exact Mass 396.339216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EsKg5BFhugG
Name ERGOSTA-5,7,22-TRIEN-3-OL, (3beta,22E)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H44O
InChI InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,18-20,22,24-26,29H,11-17H2,1-6H3/b8-7+
InChIKey DNVPQKQSNYMLRS-BQYQJAHWSA-N
Molecular Weight 396.3381
SMILES OC1CC2=CC=C3C(CCC4(C)C3CCC4C(\C=C\C(C(C)C)C)C)C2(C)CC1
SPLASH splash10-11ov-7935000000-22858b5635e852d38a0e
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany