![3-BETA-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-22-S-HYDROXYCYCLOART-24E-EN-26-OIC-ACID](/api/spectrum/IxcOvbjQsvx/structure.png?h=300&w=458 "3-BETA-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-22-S-HYDROXYCYCLOART-24E-EN-26-OIC-ACID")
| SpectraBase Compound ID | F7eQZ6IE11V |
|---|---|
| InChI | InChI=1S/C48H78O19/c1-21(40(60)61)7-8-24(52)22(2)23-11-13-46(6)29-10-9-28-44(3,4)30(12-14-47(28)20-48(29,47)16-15-45(23,46)5)65-42-38(35(57)32(54)26(18-50)63-42)67-43-39(36(58)33(55)27(19-51)64-43)66-41-37(59)34(56)31(53)25(17-49)62-41/h7,22-39,41-43,49-59H,8-20H2,1-6H3,(H,60,61)/b21-7+/t22-,23+,24-,25+,26+,27+,28-,29-,30-,31+,32+,33+,34-,35-,36-,37+,38+,39+,41-,42-,43-,45+,46-,47+,48-/m0/s1 |
| InChIKey | DNPPRXMRYPBELQ-GVMWLFKJSA-N |
| Mol Weight | 959.1 g/mol |
| Molecular Formula | C48H78O19 |
| Exact Mass | 958.51373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IxcOvbjQsvx |
|---|---|
| Name | 3-BETA-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-22-S-HYDROXYCYCLOART-24E-EN-26-OIC-ACID |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O19 |
| InChI | InChI=1S/C48H78O19/c1-21(40(60)61)7-8-24(52)22(2)23-11-13-46(6)29-10-9-28-44(3,4)30(12-14-47(28)20-48(29,47)16-15-45(23,46)5)65-42-38(35(57)32(54)26(18-50)63-42)67-43-39(36(58)33(55)27(19-51)64-43)66-41-37(59)34(56)31(53)25(17-49)62-41/h7,22-39,41-43,49-59H,8-20H2,1-6H3,(H,60,61)/b21-7+/t22-,23+,24-,25+,26+,27+,28-,29-,30-,31+,32+,33+,34-,35-,36-,37+,38+,39+,41-,42-,43-,45+,46-,47+,48-/m0/s1 |
| InChIKey | DNPPRXMRYPBELQ-GVMWLFKJSA-N |
| Literature Reference Author | M.M.CORSARO,M.D.GRECA,A.FIORENTINO,P.MONACO,L.PREVITERA |
| Literature Reference Citation | PHYTOCHEM.,37,515(1994) |
| Literature Reference DOI | 10.1016/0031-9422(94)85090-9 |
| Molecular Weight | 959.136 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS22986 |