| SpectraBase Compound ID | FKJ3BU8gPQy |
|---|---|
| InChI | InChI=1S/C29H40O27/c1-4(30)48-14-11(37)29(55-20(24(43)44)17(14)53-27-10(36)6(32)7(33)16(52-27)22(39)40)54-18-15(49-5(2)31)12(38)28(56-21(18)26(46)47-3)51-13-8(34)9(35)25(45)50-19(13)23(41)42/h6-21,25,27-29,32-38,45H,1-3H3,(H,39,40)(H,41,42)(H,43,44)/t6-,7+,8-,9-,10+,11-,12?,13-,14-,15-,16-,17-,18+,19+,20+,21-,25+,27+,28-,29+/m0/s1 |
| InChIKey | VJRSWXGXAWNIRN-KEIKTLGLSA-N |
| Mol Weight | 820.6 g/mol |
| Molecular Formula | C29H40O27 |
| Exact Mass | 820.175696 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DTrOd01rdGm |
|---|---|
| Name | ALPHA-D-GALACTURONOPYRANOSYL-(1->4)-3-O-ACETYL-ALPHA-D-GALACTURONOPYRANOSYL-(1->4)-3-O-ACETYL-ALPHA-D-GALACTURONOPYRANOSYL-METHYLESTER-(1->4 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H40O27 |
| InChI | InChI=1S/C29H40O27/c1-4(30)48-14-11(37)29(55-20(24(43)44)17(14)53-27-10(36)6(32)7(33)16(52-27)22(39)40)54-18-15(49-5(2)31)12(38)28(56-21(18)26(46)47-3)51-13-8(34)9(35)25(45)50-19(13)23(41)42/h6-21,25,27-29,32-38,45H,1-3H3,(H,39,40)(H,41,42)(H,43,44)/t6-,7+,8-,9-,10+,11-,12?,13-,14-,15-,16-,17-,18+,19+,20+,21-,25+,27+,28-,29+/m0/s1 |
| InChIKey | VJRSWXGXAWNIRN-KEIKTLGLSA-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 | 820.620 g/mol |
| Solvent | D2O |
| Source File Reference | UWMS1565 |