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KANSUININ-H;3-BETA,5-ALPHA,7-BETA,9-ALPHA,15-BETA-PENTAACETOXY-8-ALPHA-BENZOYLOXY-2-ALPHA,14-ALPHA-DIHYDROXY-11-BETA,14-BETA-EPOXYJATROPHA-6(17)-EN
SpectraBase Compound ID GNJmJbsSBrm
InChI InChI=1S/C37H46O16/c1-17-27(47-19(3)38)25-30(49-21(5)40)35(10,45)16-36(25,52-23(7)42)37(46)18(2)26(43)31(53-37)34(8,9)32(50-22(6)41)29(28(17)48-20(4)39)51-33(44)24-14-12-11-13-15-24/h11-15,18,25,27-32,45-46H,1,16H2,2-10H3/t18-,25+,27+,28+,29-,30-,31+,32-,35-,36-,37-/m1/s1
InChIKey JUCOOGZXMGBGJB-QJSVZWSMSA-N
Mol Weight 746.8 g/mol
Molecular Formula C37H46O16
Exact Mass 746.278585 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7MEAuXdRgpB
Name KANSUININ-H;3-BETA,5-ALPHA,7-BETA,9-ALPHA,15-BETA-PENTAACETOXY-8-ALPHA-BENZOYLOXY-2-ALPHA,14-ALPHA-DIHYDROXY-11-BETA,14-BETA-EPOXYJATROPHA-6(17)-EN
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H46O16
InChI InChI=1S/C37H46O16/c1-17-27(47-19(3)38)25-30(49-21(5)40)35(10,45)16-36(25,52-23(7)42)37(46)18(2)26(43)31(53-37)34(8,9)32(50-22(6)41)29(28(17)48-20(4)39)51-33(44)24-14-12-11-13-15-24/h11-15,18,25,27-32,45-46H,1,16H2,2-10H3/t18-,25+,27+,28+,29-,30-,31+,32-,35-,36-,37-/m1/s1
InChIKey JUCOOGZXMGBGJB-QJSVZWSMSA-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 746.763 g/mol
Solvent C5D5N
Source File Reference UWMZ8104