| SpectraBase Compound ID | kzB7Y2EKR4 |
|---|---|
| InChI | InChI=1S/C22H30O21/c1-3(23)37-10-7(27)13(17(30)31)41-22(9(10)29)40-11-5(25)6(26)21(43-15(11)18(32)33)42-14-12(38-4(2)24)8(28)20(36)39-16(14)19(34)35/h5-16,20-22,25-29,36H,1-2H3,(H,30,31)(H,32,33)(H,34,35)/t5-,6-,7+,8-,9+,10-,11-,12-,13-,14-,15+,16+,20+,21+,22-/m0/s1 |
| InChIKey | ISUDZMMHWKVFHY-SAZITNFUSA-N |
| Mol Weight | 630.46 g/mol |
| Molecular Formula | C22H30O21 |
| Exact Mass | 630.127958 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 80sRvONPER1 |
|---|---|
| Name | 3-O-ACETYL-ALPHA-D-GALACTURONOPYRANOSYL-(1->4)-ALPHA-D-GALACTURONOPYRANOSYL-(1->4)-3-O-ACETYL-ALPHA-D-GALACTURONOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H30O21 |
| InChI | InChI=1S/C22H30O21/c1-3(23)37-10-7(27)13(17(30)31)41-22(9(10)29)40-11-5(25)6(26)21(43-15(11)18(32)33)42-14-12(38-4(2)24)8(28)20(36)39-16(14)19(34)35/h5-16,20-22,25-29,36H,1-2H3,(H,30,31)(H,32,33)(H,34,35)/t5-,6-,7+,8-,9+,10-,11-,12-,13-,14-,15+,16+,20+,21+,22-/m0/s1 |
| InChIKey | ISUDZMMHWKVFHY-SAZITNFUSA-N |
| Literature Reference Author | P.PERRONE,C.M.HEWAGE,A.R.THOMSON,K.BAILEY,I.H.SADLER,S.C.FRY |
| Literature Reference Citation | PHYTOCHEM.,60,67(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00039-0 |
| Molecular Weight | 630.468 g/mol |
| Solvent | D2O |
| Source File Reference | UWMS1566 |