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CIS-MONTACIN

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CIS-MONTACIN
SpectraBase Compound ID 2BhbivFO6lg
InChI InChI=1S/C35H62O8/c1-3-4-5-10-14-17-31(39)33-21-22-34(43-33)32(40)18-15-12-9-7-6-8-11-13-16-28(36)25-30(38)20-19-29(37)24-27-23-26(2)42-35(27)41/h23,26,28-29,31-34,36-37,39-40H,3-22,24-25H2,1-2H3/t26-,28-,29-,31-,32+,33-,34+/m0/s1
InChIKey LLIPLAYBUOQFER-JHJHIRSBSA-N
Mol Weight 610.9 g/mol
Molecular Formula C35H62O8
Exact Mass 610.444469 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2LUnf2fvWph
Name CIS-MONTACIN
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H62O8
InChI InChI=1S/C35H62O8/c1-3-4-5-10-14-17-31(39)33-21-22-34(43-33)32(40)18-15-12-9-7-6-8-11-13-16-28(36)25-30(38)20-19-29(37)24-27-23-26(2)42-35(27)41/h23,26,28-29,31-34,36-37,39-40H,3-22,24-25H2,1-2H3/t26-,28-,29-,31-,32+,33-,34+/m0/s1
InChIKey LLIPLAYBUOQFER-JHJHIRSBSA-N
Literature Reference Author C.C.LIAW,F.R.CHANG,Y.C.WU,H.K.WANG,Y.NAKANISHI,K.F.BASTOW,K. H.LEE
Literature Reference Citation J.NAT.PROD.,67,1804(2004)
Literature Reference DOI 10.1021/np030216p
Molecular Weight 610.872 g/mol
Solvent CDCl3
Source File Reference UWMZ6688