![MALTOL-3-O-[4'-O-PARA-COUMAROYL-6'-O-(3-HYDROXY-3-METHYLGLUTAROYL)]-BETA-GLUCOPYRANOSIDE](/api/spectrum/IA4rPBCzHPe/structure.png?h=300&w=458 "MALTOL-3-O-[4'-O-PARA-COUMAROYL-6'-O-(3-HYDROXY-3-METHYLGLUTAROYL)]-BETA-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | KIOIgG24olw |
|---|---|
| InChI | InChI=1S/C27H30O14/c1-14-24(17(29)9-10-37-14)41-26-23(35)22(34)25(40-20(32)8-5-15-3-6-16(28)7-4-15)18(39-26)13-38-21(33)12-27(2,36)11-19(30)31/h3-10,18,22-23,25-26,28,34-36H,11-13H2,1-2H3,(H,30,31)/b8-5+/t18-,22-,23-,25-,26+,27?/m0/s1 |
| InChIKey | SXIGRTDBQWZBAD-VZNRNDAVSA-N |
| Mol Weight | 578.52 g/mol |
| Molecular Formula | C27H30O14 |
| Exact Mass | 578.163556 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IA4rPBCzHPe |
|---|---|
| Name | MALTOL-3-O-[4'-O-PARA-COUMAROYL-6'-O-(3-HYDROXY-3-METHYLGLUTAROYL)]-BETA-GLUCOPYRANOSIDE |
| Compound Number | 23 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H30O14 |
| InChI | InChI=1S/C27H30O14/c1-14-24(17(29)9-10-37-14)41-26-23(35)22(34)25(40-20(32)8-5-15-3-6-16(28)7-4-15)18(39-26)13-38-21(33)12-27(2,36)11-19(30)31/h3-10,18,22-23,25-26,28,34-36H,11-13H2,1-2H3,(H,30,31)/b8-5+/t18-,22-,23-,25-,26+,27?/m0/s1 |
| InChIKey | SXIGRTDBQWZBAD-VZNRNDAVSA-N |
| Literature Reference Author | G.C.KITE,C.A.STONEHAM,N.C.VEITCH |
| Literature Reference Citation | PHYTOCHEM.,68,1407(2007) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.03.004 |
| Molecular Weight | 578.527 g/mol |
| Sample ID | 62361 |
| Solvent | CD3OD |