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3-O-(6''-CAFFEOYL)-BETA-D-GALACTOPYRANOSIDE
SpectraBase Compound ID FUYuuMMNL0s
InChI InChI=1S/C30H26O15/c31-14-9-19(36)23-20(10-14)43-28(13-3-5-16(33)18(35)8-13)29(25(23)39)45-30-27(41)26(40)24(38)21(44-30)11-42-22(37)6-2-12-1-4-15(32)17(34)7-12/h1-10,21,24,26-27,30-36,38,40-41H,11H2/b6-2+/t21-,24+,26+,27-,30+/m0/s1
InChIKey IHBVMUCQCZEAPW-YBSDSQCQSA-N
Mol Weight 626.52 g/mol
Molecular Formula C30H26O15
Exact Mass 626.12717 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ALsADD9tsW8
Name 3-O-(6''-CAFFEOYL)-BETA-D-GALACTOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H26O15
InChI InChI=1S/C30H26O15/c31-14-9-19(36)23-20(10-14)43-28(13-3-5-16(33)18(35)8-13)29(25(23)39)45-30-27(41)26(40)24(38)21(44-30)11-42-22(37)6-2-12-1-4-15(32)17(34)7-12/h1-10,21,24,26-27,30-36,38,40-41H,11H2/b6-2+/t21-,24+,26+,27-,30+/m0/s1
InChIKey IHBVMUCQCZEAPW-YBSDSQCQSA-N
Literature Reference Author B.K.DATTA,S.K.DATTA,S.D.SARKER
Literature Reference Citation FITOTERAPIA,71,459(2000)
Literature Reference DOI 10.1016/S0367-326X(99)00172-0
Molecular Weight 626.527 g/mol
Solvent CD3OD
Source File Reference UWVN3847