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#30;TERNATUMOSIDE-XVII;KAEMPFEROL-3-O-[BETA-D-6-O-[4-HYDROXY-(E)-CINNAMOYL]-GLUCOPYRANOSYL-(1->3)]-BETA-D-6-O-[4-HYDROXY-(E)-CINNAMOYL]-GLUCOPYRANOSYL-(
SpectraBase Compound ID LGVt3HKD1j4
InChI InChI=1S/C63H72O34/c1-24-41(71)56(95-61-53(83)49(79)43(73)35(93-61)21-85-38(69)16-6-25-2-10-28(65)11-3-25)58(97-62-54(84)50(80)44(74)36(94-62)22-86-39(70)17-7-26-4-12-29(66)13-5-26)63(88-24)96-57-46(76)40-32(68)18-31(19-33(40)90-55(57)27-8-14-30(67)15-9-27)89-60-52(82)48(78)45(75)37(92-60)23-87-59-51(81)47(77)42(72)34(20-64)91-59/h2-19,24,34-37,41-45,47-54,56,58-68,71-75,77-84H,20-23H2,1H3/b16-6+,17-7+/t24-,34-,35+,36+,37-,41-,42-,43+,44+,45-,47+,48+,49-,50-,51-,52-,53+,54+,56+,58+,59-,60-,61-,62-,63-/m0/s1
InChIKey ZJOZTXJFNNAOIB-XBYWPFLDSA-N
Mol Weight 1373.2 g/mol
Molecular Formula C63H72O34
Exact Mass 1372.390499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bkkj0KxQfKb
Name #30;TERNATUMOSIDE-XVII;KAEMPFEROL-3-O-[BETA-D-6-O-[4-HYDROXY-(E)-CINNAMOYL]-GLUCOPYRANOSYL-(1->3)]-BETA-D-6-O-[4-HYDROXY-(E)-CINNAMOYL]-GLUCOPYRANOSYL-(
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C63H72O34
InChI InChI=1S/C63H72O34/c1-24-41(71)56(95-61-53(83)49(79)43(73)35(93-61)21-85-38(69)16-6-25-2-10-28(65)11-3-25)58(97-62-54(84)50(80)44(74)36(94-62)22-86-39(70)17-7-26-4-12-29(66)13-5-26)63(88-24)96-57-46(76)40-32(68)18-31(19-33(40)90-55(57)27-8-14-30(67)15-9-27)89-60-52(82)48(78)45(75)37(92-60)23-87-59-51(81)47(77)42(72)34(20-64)91-59/h2-19,24,34-37,41-45,47-54,56,58-68,71-75,77-84H,20-23H2,1H3/b16-6+,17-7+/t24-,34-,35+,36+,37-,41-,42-,43+,44+,45-,47+,48+,49-,50-,51-,52-,53+,54+,56+,58+,59-,60-,61-,62-,63-/m0/s1
InChIKey ZJOZTXJFNNAOIB-XBYWPFLDSA-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 1373.244 g/mol
Source File Reference UWBT4691