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BIDENLIGNASIDE-B;3-[3-[1,3-DIHYDROXY-3-(4-HYDROXY-3-METHOXYPHENYL)-PROPYL]-4-HYDROXY-5-METHOXYPHENYL]-ALLYL-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 7ebRc8rrSCw
InChI InChI=1S/C26H34O12/c1-35-19-10-14(5-6-16(19)28)17(29)11-18(30)15-8-13(9-20(36-2)22(15)31)4-3-7-37-26-25(34)24(33)23(32)21(12-27)38-26/h3-6,8-10,17-18,21,23-34H,7,11-12H2,1-2H3/b4-3+/t17?,18-,21+,23+,24-,25+,26+/m1/s1
InChIKey XSWHADNOBPLVSA-XQPIVGBSSA-N
Mol Weight 538.5 g/mol
Molecular Formula C26H34O12
Exact Mass 538.205027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ekooa5aMiqL
Name BIDENLIGNASIDE-B;3-[3-[1,3-DIHYDROXY-3-(4-HYDROXY-3-METHOXYPHENYL)-PROPYL]-4-HYDROXY-5-METHOXYPHENYL]-ALLYL-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H34O12
InChI InChI=1S/C26H34O12/c1-35-19-10-14(5-6-16(19)28)17(29)11-18(30)15-8-13(9-20(36-2)22(15)31)4-3-7-37-26-25(34)24(33)23(32)21(12-27)38-26/h3-6,8-10,17-18,21,23-34H,7,11-12H2,1-2H3/b4-3+/t17?,18-,21+,23+,24-,25+,26+/m1/s1
InChIKey XSWHADNOBPLVSA-XQPIVGBSSA-N
Literature Reference Author N.L.WANG,J.WANG,X.S.YAO,S.KITANAKA
Literature Reference Citation CHEM.PHARM.BULL.,54,1190(2006)
Literature Reference DOI 10.1248/cpb.54.1190
Molecular Weight 538.549 g/mol
Sample ID 36946
Solvent CD3OD