![4-[6-O-(4-HYDROXY-3,5-DIMETHOXYBENZOYL)-BETA-D-GLUCOPYRANOSYLOXY]-3-METHOXYBENZOIC-ACID](/api/spectrum/5ClOX338Lli/structure.png?h=300&w=458 "4-[6-O-(4-HYDROXY-3,5-DIMETHOXYBENZOYL)-BETA-D-GLUCOPYRANOSYLOXY]-3-METHOXYBENZOIC-ACID")
| SpectraBase Compound ID | LDK7uB5Gn6A |
|---|---|
| InChI | InChI=1S/C23H26O13/c1-31-13-6-10(21(28)29)4-5-12(13)35-23-20(27)19(26)18(25)16(36-23)9-34-22(30)11-7-14(32-2)17(24)15(8-11)33-3/h4-8,16,18-20,23-27H,9H2,1-3H3,(H,28,29)/t16-,18-,19+,20-,23-/m0/s1 |
| InChIKey | VZZORQCDLWXFQF-DERWQMDGSA-N |
| Mol Weight | 510.45 g/mol |
| Molecular Formula | C23H26O13 |
| Exact Mass | 510.137341 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5ClOX338Lli |
|---|---|
| Name | 4-[6-O-(4-HYDROXY-3,5-DIMETHOXYBENZOYL)-BETA-D-GLUCOPYRANOSYLOXY]-3-METHOXYBENZOIC-ACID |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H26O13 |
| InChI | InChI=1S/C23H26O13/c1-31-13-6-10(21(28)29)4-5-12(13)35-23-20(27)19(26)18(25)16(36-23)9-34-22(30)11-7-14(32-2)17(24)15(8-11)33-3/h4-8,16,18-20,23-27H,9H2,1-3H3,(H,28,29)/t16-,18-,19+,20-,23-/m0/s1 |
| InChIKey | VZZORQCDLWXFQF-DERWQMDGSA-N |
| Literature Reference Author | A.YOKOSUKA,Y.MIMAKI |
| Literature Reference Citation | CHEM.PHARM.BULL.,55,273(2007) |
| Literature Reference DOI | 10.1248/cpb.55.273 |
| Molecular Weight | 510.452 g/mol |
| Sample ID | 55430 |
| Solvent | CD3OD |