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7,4'-O-DIMETHYL-SCUTELLAREIN-6-SAMBUBIOSIDE
SpectraBase Compound ID J23YKOtEIYa
InChI InChI=1S/C28H32O15/c1-37-12-5-3-11(4-6-12)15-7-13(30)19-16(40-15)8-17(38-2)25(22(19)34)42-28-26(23(35)21(33)18(9-29)41-28)43-27-24(36)20(32)14(31)10-39-27/h3-8,14,18,20-21,23-24,26-29,31-36H,9-10H2,1-2H3/t14-,18-,20+,21-,23+,24-,26-,27+,28+/m1/s1
InChIKey FLNGHKQBVLFAGJ-IIYXSDHHSA-N
Mol Weight 608.5 g/mol
Molecular Formula C28H32O15
Exact Mass 608.17412 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hqgd2gtRj5B
Name 7,4'-O-DIMETHYL-SCUTELLAREIN-6-SAMBUBIOSIDE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H32O15
InChI InChI=1S/C28H32O15/c1-37-12-5-3-11(4-6-12)15-7-13(30)19-16(40-15)8-17(38-2)25(22(19)34)42-28-26(23(35)21(33)18(9-29)41-28)43-27-24(36)20(32)14(31)10-39-27/h3-8,14,18,20-21,23-24,26-29,31-36H,9-10H2,1-2H3/t14-,18-,20+,21-,23+,24-,26-,27+,28+/m1/s1
InChIKey FLNGHKQBVLFAGJ-IIYXSDHHSA-N
Literature Reference Author B.DAS,A.K.CHAKRAVARTY
Literature Reference Citation PHYTOCHEM.,33,493(1993)
Literature Reference DOI 10.1016/0031-9422(93)85546-4
Molecular Weight 608.553 g/mol
Solvent DMSO-D6
Source File Reference UWVN6464