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(-)-(7'-R,8'-S)-ERYTHRO-CAROLIGNAN_Y

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(-)-(7'-R,8'-S)-ERYTHRO-CAROLIGNAN_Y
SpectraBase Compound ID 9GBqh4LZ3n9
InChI InChI=1S/C40H42O12/c1-46-34-22-28(9-16-31(34)42)12-20-38(44)50-21-5-6-27-10-18-33(36(23-27)48-3)52-37(40(49-4)29-13-17-32(43)35(24-29)47-2)25-51-39(45)19-11-26-7-14-30(41)15-8-26/h7-20,22-24,37,40-43H,5-6,21,25H2,1-4H3/b19-11+,20-12+/t37-,40+/m0/s1
InChIKey XJRGSDSGSICBNP-HMCDAIPASA-N
Mol Weight 714.8 g/mol
Molecular Formula C40H42O12
Exact Mass 714.267627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5rZRp2in48L
Name (-)-(7'-S,8'-S)-THREO-CAROLIGNAN_Y
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H42O12
InChI InChI=1S/C40H42O12/c1-46-34-22-28(9-16-31(34)42)12-20-38(44)50-21-5-6-27-10-18-33(36(23-27)48-3)52-37(40(49-4)29-13-17-32(43)35(24-29)47-2)25-51-39(45)19-11-26-7-14-30(41)15-8-26/h7-20,22-24,37,40-43H,5-6,21,25H2,1-4H3/b19-11+,20-12+/t37-,40+/m0/s1
InChIKey XJRGSDSGSICBNP-HMCDAIPASA-N
Literature Reference Author X.RUDIYANSYAH,L.K.LAMBERT,M.J.GARSON
Literature Reference Citation J.NAT.PROD.,73,1649(2010)
Literature Reference DOI 10.1021/np100332v
Molecular Weight 714.766 g/mol
Sample ID 36170
Solvent CDCl3