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AZIV;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL-(1->)]-22-O-[2,3-DIHYDRO-2,5-DIHYDROXY-6-METHYL-4H-PY
SpectraBase Compound ID 8JoIXVE4vu4
InChI InChI=1S/C54H84O22/c1-23-34(59)26(58)17-33(69-23)72-32-19-49(2,3)18-25-24-9-10-30-51(5)13-12-31(52(6,22-57)29(51)11-14-54(30,8)53(24,7)16-15-50(25,32)4)73-48-44(40(65)39(64)42(74-48)45(67)68)76-47-43(38(63)36(61)28(21-56)71-47)75-46-41(66)37(62)35(60)27(20-55)70-46/h9,25,27-33,35-44,46-48,55-57,59-66H,10-22H2,1-8H3,(H,67,68)/t25?,27-,28-,29?,30?,31+,32?,33?,35-,36-,37+,38+,39+,40+,41-,42+,43-,44-,46+,47+,48-,50-,51+,52+,53-,54-/m1/s1
InChIKey YLBMNMLHAAOXAL-OSWGWMIJSA-N
Mol Weight 1085.2 g/mol
Molecular Formula C54H84O22
Exact Mass 1084.545424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9n71SDvz02K
Name AZIV;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL-(1->)]-22-O-[2,3-DIHYDRO-2,5-DIHYDROXY-6-METHYL-4H-PY
Compound Number 3
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H84O22
InChI InChI=1S/C54H84O22/c1-23-34(59)26(58)17-33(69-23)72-32-19-49(2,3)18-25-24-9-10-30-51(5)13-12-31(52(6,22-57)29(51)11-14-54(30,8)53(24,7)16-15-50(25,32)4)73-48-44(40(65)39(64)42(74-48)45(67)68)76-47-43(38(63)36(61)28(21-56)71-47)75-46-41(66)37(62)35(60)27(20-55)70-46/h9,25,27-33,35-44,46-48,55-57,59-66H,10-22H2,1-8H3,(H,67,68)/t25?,27-,28-,29?,30?,31+,32?,33?,35-,36-,37+,38+,39+,40+,41-,42+,43-,44-,46+,47+,48-,50-,51+,52+,53-,54-/m1/s1
InChIKey YLBMNMLHAAOXAL-OSWGWMIJSA-N
Literature Reference Author T.IIDA,Y.YOSHIKI,K.OKUBO,H.OHRUI,J.KINJO,T.NOHARA
Literature Reference Citation PHYTOCHEM.,51,1055(1999)
Literature Reference DOI 10.1016/S0031-9422(99)00148-X
Molecular Weight 1085.248 g/mol
Solvent DMSO-D6
Source File Reference UWVN11019