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ABACOPTERIN_H;(2-S,4-R)-7-HYDROXY-4'-METHOXY-6-METHOXYMETHYL-8-METHYL-4,2''-OXIDOFLAVAN-5-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 49qDVAvLlCI
InChI InChI=1S/C25H30O10/c1-11-19(27)14(10-30-2)23-18-16(33-24-21(29)20(28)17(9-26)34-25(24)35-23)8-15(32-22(11)18)12-4-6-13(31-3)7-5-12/h4-7,15-17,20-21,24-29H,8-10H2,1-3H3/t15-,16-,17+,20+,21-,24+,25-/m0/s1
InChIKey ZVRUQULOIBIROB-QYNZPOCSSA-N
Mol Weight 490.51 g/mol
Molecular Formula C25H30O10
Exact Mass 490.183897 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JrAQEVoXqR6
Name ABACOPTERIN_H;(2-S,4-R)-7-HYDROXY-4'-METHOXY-6-METHOXYMETHYL-8-METHYL-4,2''-OXIDOFLAVAN-5-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H30O10
InChI InChI=1S/C25H30O10/c1-11-19(27)14(10-30-2)23-18-16(33-24-21(29)20(28)17(9-26)34-25(24)35-23)8-15(32-22(11)18)12-4-6-13(31-3)7-5-12/h4-7,15-17,20-21,24-29H,8-10H2,1-3H3/t15-,16-,17+,20+,21-,24+,25-/m0/s1
InChIKey ZVRUQULOIBIROB-QYNZPOCSSA-N
Literature Reference Author Z.ZHAO,J.JIN,J.RUAN,C.ZHU,C.LIN,W.FANG,Y.CAI
Literature Reference Citation J.NAT.PROD.,70,1683(2007)
Literature Reference DOI 10.1021/np0703850
Molecular Weight 490.507 g/mol
Sample ID 31739
Solvent C5D5N