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INDIOSIDE_K;3-O-{ALPHA-L-RHAMNOPYRANOSIDE-(1->2)-O-[ALPHA-L-RHAMNOPYRANOSIDE-(1->4)]-BETA-D-GLUCOPYRANOSYL}
SpectraBase Compound ID 1P79WvYdtHJ
InChI InChI=1S/C48H78O18/c1-8-15-58-42-20(2)16-31(63-42)48(57)21(3)32-29(66-48)18-28-26-10-9-24-17-25(11-13-46(24,6)27(26)12-14-47(28,32)7)61-45-41(65-44-38(55)36(53)34(51)23(5)60-44)39(56)40(30(19-49)62-45)64-43-37(54)35(52)33(50)22(4)59-43/h9,20-23,25-45,49-57H,8,10-19H2,1-7H3/t20-,21+,22+,23+,25+,26-,27+,28+,29+,30-,31+,32+,33+,34+,35-,36-,37-,38-,39+,40-,41-,42-,43+,44+,45-,46+,47+,48+/m1/s1
InChIKey CUCZREQAASDFOM-YZQURHEVSA-N
Mol Weight 943.1 g/mol
Molecular Formula C48H78O18
Exact Mass 942.518816 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I5vL9GEekNz
Name INDIOSIDE_K;3-O-{ALPHA-L-RHAMNOPYRANOSIDE-(1->2)-O-[ALPHA-L-RHAMNOPYRANOSIDE-(1->4)]-BETA-D-GLUCOPYRANOSYL}
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H78O18
InChI InChI=1S/C48H78O18/c1-8-15-58-42-20(2)16-31(63-42)48(57)21(3)32-29(66-48)18-28-26-10-9-24-17-25(11-13-46(24,6)27(26)12-14-47(28,32)7)61-45-41(65-44-38(55)36(53)34(51)23(5)60-44)39(56)40(30(19-49)62-45)64-43-37(54)35(52)33(50)22(4)59-43/h9,20-23,25-45,49-57H,8,10-19H2,1-7H3/t20-,21+,22+,23+,25+,26-,27+,28+,29+,30-,31+,32+,33+,34+,35-,36-,37-,38-,39+,40-,41-,42-,43+,44+,45-,46+,47+,48+/m1/s1
InChIKey CUCZREQAASDFOM-YZQURHEVSA-N
Literature Reference Author C.T.YEN,C.L.LEE,F.R.CHANG,T.L.HWANG,H.F.YEN,C.J.CHEN,S.L.CHE N,Y.C.WU
Literature Reference Citation J.NAT.PROD.,75,636(2012)
Literature Reference DOI 10.1021/np200877u
Molecular Weight 943.137 g/mol
Sample ID 40260
Solvent C5D5N