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VITISIN-A;FLAVYLIUM-CATION;3-FORMYL-4-D-BETA-GLUCOPYRANOSYLOXY-8-HYDROXY-5-(4-HYDROXY-3,5-DIMETHOXY)-PHEHYL-2-OXO-1,6-DIOXA-2,3-DIHYDROPHENALENE

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VITISIN-A;FLAVYLIUM-CATION;3-FORMYL-4-D-BETA-GLUCOPYRANOSYLOXY-8-HYDROXY-5-(4-HYDROXY-3,5-DIMETHOXY)-PHEHYL-2-OXO-1,6-DIOXA-2,3-DIHYDROPHENALENE
SpectraBase Compound ID 9hRMH73onYB
InChI InChI=1S/C26H24O14/c1-35-14-3-9(4-15(36-2)19(14)30)23-24(40-26-22(33)21(32)20(31)16(8-28)39-26)17-11(7-27)25(34)38-13-6-10(29)5-12(37-23)18(13)17/h3-7,16,20-22,26,28,31-33H,8H2,1-2H3,(H2-,27,29,30,34)/p+1/t16-,20-,21+,22-,26+/m1/s1
InChIKey JFZGELASTHTLTI-DMRYIZGCSA-O
Mol Weight 561.47 g/mol
Molecular Formula C26H25O14
Exact Mass 561.12443 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KpF8JJgaFra
Name VITISIN-A;FLAVYLIUM-CATION;3-FORMYL-4-D-BETA-GLUCOPYRANOSYLOXY-8-HYDROXY-5-(4-HYDROXY-3,5-DIMETHOXY)-PHEHYL-2-OXO-1,6-DIOXA-2,3-DIHYDROPHENALENE
Compound Number I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H25O14
InChI InChI=1S/C26H24O14/c1-35-14-3-9(4-15(36-2)19(14)30)23-24(40-26-22(33)21(32)20(31)16(8-28)39-26)17-11(7-27)25(34)38-13-6-10(29)5-12(37-23)18(13)17/h3-7,16,20-22,26,28,31-33H,8H2,1-2H3,(H2-,27,29,30,34)/p+1/t16-,20-,21+,22-,26+/m1/s1
InChIKey JFZGELASTHTLTI-DMRYIZGCSA-O
Literature Reference Author J.BAKKER,P.BRIDLE,T.HONDA,H.KUWANO,N.SAITO,N.TERAHARA,C.F.TI MBERLAKE
Literature Reference Citation PHYTOCHEM.,44,1375(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00707-8
Molecular Weight 561.476 g/mol
Solvent DMSO-D6:TFA=9:1
Source File Reference UWAN33