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ACANTHOVAGASTEROID-C;(22E,24S)-24-METHYLCHOLESTA-5,22-DIENE-3-BETA,19-DIOL
SpectraBase Compound ID 23IMJIiZEuj
InChI InChI=1S/C28H46O2/c1-18(2)19(3)6-7-20(4)24-10-11-25-23-9-8-21-16-22(30)12-15-28(21,17-29)26(23)13-14-27(24,25)5/h6-8,18-20,22-26,29-30H,9-17H2,1-5H3/b7-6+/t19-,20+,22-,23?,24+,25?,26?,27+,28+/m0/s1
InChIKey COMISLYNEQPREW-KGADNILTSA-N
Mol Weight 414.7 g/mol
Molecular Formula C28H46O2
Exact Mass 414.349781 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Pu2JUvZIsJ
Name ACANTHOVAGASTEROID-C;(22E,24S)-24-METHYLCHOLESTA-5,22-DIENE-3-BETA,19-DIOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H46O2
InChI InChI=1S/C28H46O2/c1-18(2)19(3)6-7-20(4)24-10-11-25-23-9-8-21-16-22(30)12-15-28(21,17-29)26(23)13-14-27(24,25)5/h6-8,18-20,22-26,29-30H,9-17H2,1-5H3/b7-6+/t19-,20+,22-,23?,24+,25?,26?,27+,28+/m0/s1
InChIKey COMISLYNEQPREW-KGADNILTSA-N
Literature Reference Author W.ZHANG,Y.W.GUO,E.MOLLO,A.FONTANO,G.CIMINO
Literature Reference Citation J.NAT.PROD.,67,2083(2004)
Literature Reference DOI 10.1021/np049859a
Molecular Weight 414.672 g/mol
Solvent CDCl3
Source File Reference UWMZ6878