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10-O-(E)-PARA-COUMAROYL-GENIPOSIDIC-ACID
SpectraBase Compound ID Jr2tgX2sN1N
InChI InChI=1S/C25H28O12/c26-9-17-20(29)21(30)22(31)25(36-17)37-24-19-13(4-7-15(19)16(11-35-24)23(32)33)10-34-18(28)8-3-12-1-5-14(27)6-2-12/h1-6,8,11,15,17,19-22,24-27,29-31H,7,9-10H2,(H,32,33)/b8-3+/t15-,17+,19-,20+,21-,22+,24+,25-/m1/s1
InChIKey WXGBDNHYNHTQSM-AZERTPNXSA-N
Mol Weight 520.49 g/mol
Molecular Formula C25H28O12
Exact Mass 520.158076 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IHy4Ow0CrRf
Name 10-O-(E)-PARA-COUMAROYL-GENIPOSIDIC-ACID
Compound Number 18 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O12
InChI InChI=1S/C25H28O12/c26-9-17-20(29)21(30)22(31)25(36-17)37-24-19-13(4-7-15(19)16(11-35-24)23(32)33)10-34-18(28)8-3-12-1-5-14(27)6-2-12/h1-6,8,11,15,17,19-22,24-27,29-31H,7,9-10H2,(H,32,33)/b8-3+/t15-,17+,19-,20+,21-,22+,24+,25-/m1/s1
InChIKey WXGBDNHYNHTQSM-AZERTPNXSA-N
Literature Reference Author B.DINDA,S.DEBNATH,Y.HARIGAYA
Literature Reference Citation CHEM.PHARM.BULL.,55,159(2007)
Literature Reference DOI 10.1248/cpb.55.159
Molecular Weight 520.490 g/mol
Sample ID 37984
Solvent CD3OD