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CARYOCAROSIDE_IV-6;3-O-BETA-D-METHYL-GLUCOPYRANOSIDURONATE-2-BETA-HYDROXYOLEANOLIC_ACID
SpectraBase Compound ID 6Vtxgn77Ify
InChI InChI=1S/C37H58O10/c1-32(2)13-15-37(31(43)44)16-14-35(6)19(20(37)17-32)9-10-23-34(5)18-21(38)28(33(3,4)22(34)11-12-36(23,35)7)47-30-26(41)24(39)25(40)27(46-30)29(42)45-8/h9,20-28,30,38-41H,10-18H2,1-8H3,(H,43,44)/t20-,21-,22-,23+,24-,25-,26+,27-,28-,30-,34-,35+,36+,37-/m0/s1
InChIKey JAUZPMMPMKPQQP-HECLTFADSA-N
Mol Weight 662.9 g/mol
Molecular Formula C37H58O10
Exact Mass 662.402998 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FFeBhTiZkpa
Name CARYOCAROSIDE_IV-6;3-O-BETA-D-METHYL-GLUCOPYRANOSIDURONATE-2-BETA-HYDROXYOLEANOLIC_ACID
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H58O10
InChI InChI=1S/C37H58O10/c1-32(2)13-15-37(31(43)44)16-14-35(6)19(20(37)17-32)9-10-23-34(5)18-21(38)28(33(3,4)22(34)11-12-36(23,35)7)47-30-26(41)24(39)25(40)27(46-30)29(42)45-8/h9,20-28,30,38-41H,10-18H2,1-8H3,(H,43,44)/t20-,21-,22-,23+,24-,25-,26+,27-,28-,30-,34-,35+,36+,37-/m0/s1
InChIKey JAUZPMMPMKPQQP-HECLTFADSA-N
Literature Reference Author A.A.MAGID,L.VOUTQUENNE,C.MORETTI,C.LONG,C.LAVAUD
Literature Reference Citation J.NAT.PROD.,69,196(2006)
Literature Reference DOI 10.1021/np050336s
Molecular Weight 662.862 g/mol
Solvent CD3OD
Source File Reference UWMZ18502