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QUERCETIN-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->6)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-(4-O-TRANS-P-COUMAROYL)-BETA-D-GALACTOPYRANOSIDE-7-O-ALPHA-L-RHAMNOPY
SpectraBase Compound ID 2RkSzBJRx73
InChI InChI=1S/C48H56O26/c1-16-30(54)34(58)37(61)45(66-16)65-15-27-42(72-28(53)11-6-19-4-8-21(49)9-5-19)40(64)44(74-47-39(63)36(60)32(56)18(3)68-47)48(71-27)73-43-33(57)29-25(52)13-22(69-46-38(62)35(59)31(55)17(2)67-46)14-26(29)70-41(43)20-7-10-23(50)24(51)12-20/h4-14,16-18,27,30-32,34-40,42,44-52,54-56,58-64H,15H2,1-3H3/b11-6+/t16-,17+,18-,27-,30-,31+,32-,34+,35-,36+,37+,38-,39+,40+,42+,44-,45+,46+,47-,48+/m1/s1
InChIKey FSYBLFADTRSXRO-HTIAKZIESA-N
Mol Weight 1048.9 g/mol
Molecular Formula C48H56O26
Exact Mass 1048.305982 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IvmTFye9AbL
Name QUERCETIN-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->6)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-(4-O-TRANS-P-COUMAROYL)-BETA-D-GALACTOPYRANOSIDE-7-O-ALPHA-L-RHAMNOPY
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H56O26
InChI InChI=1S/C48H56O26/c1-16-30(54)34(58)37(61)45(66-16)65-15-27-42(72-28(53)11-6-19-4-8-21(49)9-5-19)40(64)44(74-47-39(63)36(60)32(56)18(3)68-47)48(71-27)73-43-33(57)29-25(52)13-22(69-46-38(62)35(59)31(55)17(2)67-46)14-26(29)70-41(43)20-7-10-23(50)24(51)12-20/h4-14,16-18,27,30-32,34-40,42,44-52,54-56,58-64H,15H2,1-3H3/b11-6+/t16-,17+,18-,27-,30-,31+,32-,34+,35-,36+,37+,38-,39+,40+,42+,44-,45+,46+,47-,48+/m1/s1
InChIKey FSYBLFADTRSXRO-HTIAKZIESA-N
Literature Reference Author A.ITOH,T.KUMASHIRO,T.TANAHASHI,N.NAGAKURA,T.NISHI
Literature Reference Citation J.NAT.PROD.,65,352(2002)
Literature Reference DOI 10.1021/np010518w
Molecular Weight 1048.957 g/mol
Solvent DMSO-D6
Source File Reference UWSI4061