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#20;TERNATUMOSIDE-X;KAEMPFEROL-3-O-[BETA-D-6-O-[4-HYDROXY-(E)-CINNAMOYL]-GLUCOPYRANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-7-O
SpectraBase Compound ID Fd09P3tku39
InChI InChI=1S/C48H56O26/c1-17-30(54)35(59)38(62)45(66-17)68-23-13-24(52)29-25(14-23)69-41(20-6-10-22(51)11-7-20)43(34(29)58)73-48-44(74-46-39(63)36(60)32(56)26(15-49)70-46)42(31(55)18(2)67-48)72-47-40(64)37(61)33(57)27(71-47)16-65-28(53)12-5-19-3-8-21(50)9-4-19/h3-14,17-18,26-27,30-33,35-40,42,44-52,54-57,59-64H,15-16H2,1-2H3/b12-5+/t17-,18+,26-,27+,30-,31+,32-,33+,35+,36+,37-,38+,39-,40+,42-,44-,45-,46+,47-,48+/m1/s1
InChIKey NUAQGKXKKPKPGL-OOAMFFMDSA-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 6ZIZaVZEigH
Name #20;TERNATUMOSIDE-X;KAEMPFEROL-3-O-[BETA-D-6-O-[4-HYDROXY-(E)-CINNAMOYL]-GLUCOPYRANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-7-O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H56O26
InChI InChI=1S/C48H56O26/c1-17-30(54)35(59)38(62)45(66-17)68-23-13-24(52)29-25(14-23)69-41(20-6-10-22(51)11-7-20)43(34(29)58)73-48-44(74-46-39(63)36(60)32(56)26(15-49)70-46)42(31(55)18(2)67-48)72-47-40(64)37(61)33(57)27(71-47)16-65-28(53)12-5-19-3-8-21(50)9-4-19/h3-14,17-18,26-27,30-33,35-40,42,44-52,54-57,59-64H,15-16H2,1-2H3/b12-5+/t17-,18+,26-,27+,30-,31+,32-,33+,35+,36+,37-,38+,39-,40+,42-,44-,45-,46+,47-,48+/m1/s1
InChIKey NUAQGKXKKPKPGL-OOAMFFMDSA-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 1048.957 g/mol
Source File Reference UWBT4683