| SpectraBase Compound ID | LAVuyYYlBAn |
|---|---|
| InChI | InChI=1S/C16H22O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h2,5,7,9-13,15-20H,3-4H2,1H3,(H,21,22)/t7-,9-,10-,11-,12+,13-,15+,16+/m0/s1 |
| InChIKey | HOKQPTUPMSNUAF-UWQPTLNXSA-N |
| Mol Weight | 358.34 g/mol |
| Molecular Formula | C16H22O9 |
| Exact Mass | 358.126382 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CQ4hEWmgy6N |
|---|---|
| Name | NEPETANUDOSIDE-B |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H22O9 |
| InChI | InChI=1S/C16H22O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h2,5,7,9-13,15-20H,3-4H2,1H3,(H,21,22)/t7-,9-,10-,11-,12+,13-,15+,16+/m0/s1 |
| InChIKey | HOKQPTUPMSNUAF-UWQPTLNXSA-N |
| Literature Reference Author | Y.TAKEDA,T.YAGI,T.MATSUMOTO,G.HONDA,M.TABATA,T.FUJITA,T.SHIN GU,H.OTSUKA,E.SEZIK, |
| Literature Reference Citation | PHYTOCHEM.,42,1085(1996) |
| Literature Reference DOI | 10.1016/0031-9422(96)00074-X |
| Molecular Weight | 358.345 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN2934 |