| SpectraBase Compound ID | 7lYpJ466s4L |
|---|---|
| InChI | InChI=1S/C21H24O15S.Na/c1-31-13-4-3-10(7-14(13)32-2)34-21-19(18(26)17(25)15(35-21)8-33-37(28,29)30)36-20(27)9-5-11(22)16(24)12(23)6-9;/h3-7,15,17-19,21-26H,8H2,1-2H3,(H,28,29,30);/q;+1/p-1/t15-,17-,18+,19-,21-;/m1./s1 |
| InChIKey | MMZOGNUUNVNNHQ-BTTVDUMLSA-M |
| Mol Weight | 570.45 g/mol |
| Molecular Formula | C21H23NaO15S |
| Exact Mass | 570.065535 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EeMmF5otb2y |
|---|---|
| Name | 1-O-3',4'-DIMETHOXYPHENYL-(2-O-GALLOYL-6-O-SULFATE)-BETA-D-GLUCOPYRANOSIDE_SODIUM_SALT |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H23NaO15S |
| InChI | InChI=1S/C21H24O15S.Na/c1-31-13-4-3-10(7-14(13)32-2)34-21-19(18(26)17(25)15(35-21)8-33-37(28,29)30)36-20(27)9-5-11(22)16(24)12(23)6-9;/h3-7,15,17-19,21-26H,8H2,1-2H3,(H,28,29,30);/q;+1/p-1/t15-,17-,18+,19-,21-;/m1./s1 |
| InChIKey | MMZOGNUUNVNNHQ-BTTVDUMLSA-M |
| Literature Reference Author | A.A.MAGID,L.VOUTQUENNE-NAZABADIOKO,D.HARAKAT,C.MORETTI,C.LAV AUD |
| Literature Reference Citation | J.NAT.PROD.,71,914(2008) |
| Literature Reference DOI | 10.1021/np800015p |
| Molecular Weight | 570.454 g/mol |
| Sample ID | 28352 |
| Solvent | CD3OD |