![AZII;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL-(1->)]-22-O-[2,3-DIHYDRO-2,5-DIHYDROXY-6-METHYL-4](/api/spectrum/1bJE7QMtPrS/structure.png?h=300&w=458 "AZII;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL-(1->)]-22-O-[2,3-DIHYDRO-2,5-DIHYDROXY-6-METHYL-4")
| SpectraBase Compound ID | GFYvcCg4gnd |
|---|---|
| InChI | InChI=1S/C54H82O23/c1-22-32(58)25(57)17-31(70-22)72-30-19-49(2,3)18-24-23-9-10-28-51(5)13-12-29(52(6,21-56)27(51)11-14-54(28,8)53(23,7)16-15-50(24,30)4)73-47-42(37(63)35(61)40(74-47)44(66)67)77-48-43(38(64)36(62)41(75-48)45(68)69)76-46-39(65)34(60)33(59)26(20-55)71-46/h9,24,26-31,33-43,46-48,55-56,58-65H,10-21H2,1-8H3,(H,66,67)(H,68,69)/t24?,26-,27?,28?,29+,30-,31?,33-,34+,35+,36+,37+,38+,39-,40+,41+,42-,43-,46+,47-,48+,50-,51+,52+,53-,54-/m1/s1 |
| InChIKey | XIOUCIKZATWNIJ-VVXPTEQRSA-N |
| Mol Weight | 1099.2 g/mol |
| Molecular Formula | C54H82O23 |
| Exact Mass | 1098.524689 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1bJE7QMtPrS |
|---|---|
| Name | AZII;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL-(1->)]-22-O-[2,3-DIHYDRO-2,5-DIHYDROXY-6-METHYL-4 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H82O23 |
| InChI | InChI=1S/C54H82O23/c1-22-32(58)25(57)17-31(70-22)72-30-19-49(2,3)18-24-23-9-10-28-51(5)13-12-29(52(6,21-56)27(51)11-14-54(28,8)53(23,7)16-15-50(24,30)4)73-47-42(37(63)35(61)40(74-47)44(66)67)77-48-43(38(64)36(62)41(75-48)45(68)69)76-46-39(65)34(60)33(59)26(20-55)71-46/h9,24,26-31,33-43,46-48,55-56,58-65H,10-21H2,1-8H3,(H,66,67)(H,68,69)/t24?,26-,27?,28?,29+,30-,31?,33-,34+,35+,36+,37+,38+,39-,40+,41+,42-,43-,46+,47-,48+,50-,51+,52+,53-,54-/m1/s1 |
| InChIKey | XIOUCIKZATWNIJ-VVXPTEQRSA-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 | 1099.231 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN11017 |