| SpectraBase Compound ID | 4p8YShF4u0i |
|---|---|
| InChI | InChI=1S/C32H54O14/c1-19(43-30-26(25(36)24(35)22(16-33)45-30)46-31-27(37)32(41,17-34)18-42-31)14-12-10-8-6-4-3-5-7-9-11-13-15-21-23(28(38)39)20(2)29(40)44-21/h19,21-27,30-31,33-37,41H,2-18H2,1H3,(H,38,39)/t19-,21-,22+,23+,24+,25-,26+,27-,30+,31-,32+/m0/s1 |
| InChIKey | BBVNKHYQJVPJSQ-SOSNZIDLSA-N |
| Mol Weight | 662.8 g/mol |
| Molecular Formula | C32H54O14 |
| Exact Mass | 662.351356 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6hYK7gHxcxw |
|---|---|
| Name | (3S,4R,18R)-18-O-BETA-D-APIOFURANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE-MUROLIC-ACID |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H54O14 |
| InChI | InChI=1S/C32H54O14/c1-19(43-30-26(25(36)24(35)22(16-33)45-30)46-31-27(37)32(41,17-34)18-42-31)14-12-10-8-6-4-3-5-7-9-11-13-15-21-23(28(38)39)20(2)29(40)44-21/h19,21-27,30-31,33-37,41H,2-18H2,1H3,(H,38,39)/t19-,21-,22+,23+,24+,25-,26+,27-,30+,31-,32+/m0/s1 |
| InChIKey | BBVNKHYQJVPJSQ-SOSNZIDLSA-N |
| Literature Reference Author | T.REZANKA,I.A.GUSCHINA |
| Literature Reference Citation | PHYTOCHEM.,54,635(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00147-3 |
| Molecular Weight | 662.772 g/mol |
| Solvent | Unknown |
| Source File Reference | UWLU1405 |