| SpectraBase Compound ID | Fiznva2iMM4 |
|---|---|
| InChI | InChI=1S/C26H35NO11/c1-4-13-15(8-17-14-9-19(35-3)18(34-2)7-12(14)5-6-27-17)16(24(32)33)11-36-25(13)38-26-23(31)22(30)21(29)20(10-28)37-26/h4,7,9,11,13,15,17,20-23,25-31H,1,5-6,8,10H2,2-3H3,(H,32,33)/t13-,15+,17-,20+,21+,22-,23+,25+,26-/m1/s1 |
| InChIKey | BTFMYVDAWDKTHJ-QZVCTVDXSA-N |
| Mol Weight | 537.6 g/mol |
| Molecular Formula | C26H35NO11 |
| Exact Mass | 537.221011 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4UYDRqN57LJ |
|---|---|
| Name | 6,7-DI-O-METHYL-N-DEACETYLISOIPECOSIDIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H35NO11 |
| InChI | InChI=1S/C26H35NO11/c1-4-13-15(8-17-14-9-19(35-3)18(34-2)7-12(14)5-6-27-17)16(24(32)33)11-36-25(13)38-26-23(31)22(30)21(29)20(10-28)37-26/h4,7,9,11,13,15,17,20-23,25-31H,1,5-6,8,10H2,2-3H3,(H,32,33)/t13-,15+,17-,20+,21+,22-,23+,25+,26-/m1/s1 |
| InChIKey | BTFMYVDAWDKTHJ-QZVCTVDXSA-N |
| Literature Reference Author | A.ITOH,T.TANAHASHI,M.TABATA,M.SHIKATA,M.KAKITE,M.NAGAI,N.NAG AKURA |
| Literature Reference Citation | PHYTOCHEM.,56,623(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00417-9 |
| Molecular Weight | 537.564 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN1836 |