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WUSHANKAEMPFEROL;KAEMPFEROL-3-O-ALPHA-L-[2,3-DI-O-BETA-D-(6-(E)-PARA-COUMAROYL)-GLUCOPYRANOSYL]-RHAMNOPYRANOSYL-7-O-ALPHA-L-RHAMNOPYRANOSIDE
SpectraBase Compound ID 3WrwfzRxl0e
InChI InChI=1S/C57H62O28/c1-23-39(64)44(69)47(72)54(77-23)79-31-19-32(61)38-33(20-31)80-50(27-9-15-30(60)16-10-27)52(43(38)68)84-57-53(85-56-49(74)46(71)42(67)35(82-56)22-76-37(63)18-8-26-5-13-29(59)14-6-26)51(40(65)24(2)78-57)83-55-48(73)45(70)41(66)34(81-55)21-75-36(62)17-7-25-3-11-28(58)12-4-25/h3-20,23-24,34-35,39-42,44-49,51,53-61,64-67,69-74H,21-22H2,1-2H3/b17-7+,18-8+/t23-,24+,34-,35-,39-,40+,41-,42-,44+,45+,46+,47+,48-,49-,51-,53-,54-,55+,56+,57+/m1/s1
InChIKey SEWIYUNHGIICRG-HWQZGTEVSA-N
Mol Weight 1195.1 g/mol
Molecular Formula C57H62O28
Exact Mass 1194.342761 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1t91oj8byQa
Name #21;KAEMPFEROL-3-O-[BETA-D-6-O-[4-HYDROXY-(E)-CINNAMOYL]-GLUCOPYRANOSYL-(1->3)]-BETA-D-6-O-[4-HYDROXY-(E)-CINNAMOYL]-GLUCOPYRANOSYL-(1->2)-ALPHA-L-RHAMN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C57H62O28
InChI InChI=1S/C57H62O28/c1-23-39(64)44(69)47(72)54(77-23)79-31-19-32(61)38-33(20-31)80-50(27-9-15-30(60)16-10-27)52(43(38)68)84-57-53(85-56-49(74)46(71)42(67)35(82-56)22-76-37(63)18-8-26-5-13-29(59)14-6-26)51(40(65)24(2)78-57)83-55-48(73)45(70)41(66)34(81-55)21-75-36(62)17-7-25-3-11-28(58)12-4-25/h3-20,23-24,34-35,39-42,44-49,51,53-61,64-67,69-74H,21-22H2,1-2H3/b17-7+,18-8+/t23-,24+,34-,35-,39-,40+,41-,42-,44+,45+,46+,47+,48-,49-,51-,53-,54-,55+,56+,57+/m1/s1
InChIKey SEWIYUNHGIICRG-HWQZGTEVSA-N
Literature Reference Author T.WARASHINA,K.UMEHARA,T.MIYASE
Literature Reference Citation CHEM.PHARM.BULL.,60,1561(2012)
Literature Reference DOI 10.1248/cpb.c12-00744
Molecular Weight 1195.102 g/mol
Source File Reference UWBT4684