| SpectraBase Compound ID | GL5ghbmdA7n |
|---|---|
| InChI | InChI=1S/C13H20N2O8/c1-15-9(17)3-6(21-2)7(4-14)22-13-12(20)11(19)10(18)8(5-16)23-13/h8,10-13,16,18-20H,3,5H2,1-2H3,(H,15,17)/b7-6-/t8-,10-,11+,12-,13-/m0/s1 |
| InChIKey | BASCBPSXFTXREB-YTPUCAJQSA-N |
| Mol Weight | 332.31 g/mol |
| Molecular Formula | C13H20N2O8 |
| Exact Mass | 332.121966 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 18Ep2Ih4M01 |
|---|---|
| Name | SECO-ACALYPHIN;(Z)-2-BETA-D-GLUCOPYRANOSYLOXY-3-METHOXY-4-(N-METHYLCARBAMOYL)-BUT-2-EN-NITRILE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H20N2O8 |
| InChI | InChI=1S/C13H20N2O8/c1-15-9(17)3-6(21-2)7(4-14)22-13-12(20)11(19)10(18)8(5-16)23-13/h8,10-13,16,18-20H,3,5H2,1-2H3,(H,15,17)/b7-6-/t8-,10-,11+,12-,13-/m0/s1 |
| InChIKey | BASCBPSXFTXREB-YTPUCAJQSA-N |
| Literature Reference Author | M.HUNGELING,M.LECHTENBERG,F.R.FRONCZEK,A.NAHRSTEDT |
| Literature Reference Citation | PHYTOCHEM.,70,270(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.12.011 |
| Molecular Weight | 332.310 g/mol |
| Sample ID | 64513 |
| Solvent | DMSO-D6 |