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KANSUININ-G;3-BETA,5-ALPHA,7-BETA,15-BETA-TETRAACETOXY-9-ALPHA-NICOTINOYLOXY-11-ALPHA,12-BETA-EPOXYJATROPHA-6(17)-EN-14-ONE
SpectraBase Compound ID DIQtjWn2j4k
InChI InChI=1S/C34H43NO12/c1-16-14-34(47-22(7)39)26(27(16)43-20(5)37)28(44-21(6)38)17(2)24(42-19(4)36)13-25(45-32(41)23-11-10-12-35-15-23)33(8,9)31-29(46-31)18(3)30(34)40/h10-12,15-16,18,24-29,31H,2,13-14H2,1,3-9H3/t16-,18+,24+,25+,26+,27-,28-,29+,31-,34+/m0/s1
InChIKey YAQJUDMDTLVWQD-QEIDTUIESA-N
Mol Weight 657.7 g/mol
Molecular Formula C34H43NO12
Exact Mass 657.278526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 33SNXi28Amm
Name KANSUININ-G;3-BETA,5-ALPHA,7-BETA,15-BETA-TETRAACETOXY-9-ALPHA-NICOTINOYLOXY-11-ALPHA,12-BETA-EPOXYJATROPHA-6(17)-EN-14-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H43NO12
InChI InChI=1S/C34H43NO12/c1-16-14-34(47-22(7)39)26(27(16)43-20(5)37)28(44-21(6)38)17(2)24(42-19(4)36)13-25(45-32(41)23-11-10-12-35-15-23)33(8,9)31-29(46-31)18(3)30(34)40/h10-12,15-16,18,24-29,31H,2,13-14H2,1,3-9H3/t16-,18+,24+,25+,26+,27-,28-,29+,31-,34+/m0/s1
InChIKey YAQJUDMDTLVWQD-QEIDTUIESA-N
Literature Reference Author Q.PAN,F.C.IP,N.Y.IP,H.X.ZHU,Z.D.MIN
Literature Reference Citation J.NAT.PROD.,67,1548(2004)
Literature Reference DOI 10.1021/np030541c
Molecular Weight 657.715 g/mol
Solvent C5D5N
Source File Reference UWMZ8102