| SpectraBase Compound ID | IglR012I7IK |
|---|---|
| InChI | InChI=1S/C20H29NO10/c1-9-4-5-10-11(18(28)21-6-2-3-13(23)24)8-29-19(14(9)10)31-20-17(27)16(26)15(25)12(7-22)30-20/h4,8,10,12,14-17,19-20,22,25-27H,2-3,5-7H2,1H3,(H,21,28)(H,23,24)/t10-,12+,14-,15+,16-,17+,19+,20-/m1/s1 |
| InChIKey | DSMIDRIKIGIMKK-CIDQBWSNSA-N |
| Mol Weight | 443.45 g/mol |
| Molecular Formula | C20H29NO10 |
| Exact Mass | 443.179146 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gs9BV1ntuWW |
|---|---|
| Name | 10-DEOXY-GENIPOSIDEE-11-GAMMA-AMINO-BUTURYC-ACID-AMIDE |
| Comments | The two shift-values 140.33 and 116.54 have been exchanged -compared to the publication |
| Compound Number | 30 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C20H29NO10/c1-9-4-5-10-11(18(28)21-6-2-3-13(23)24)8-29-19(14(9)10)31-20-17(27)16(26)15(25)12(7-22)30-20/h4,8,10,12,14-17,19-20,22,25-27H,2-3,5-7H2,1H3,(H,21,28)(H,23,24)/t10-,12+,14-,15+,16-,17+,19+,20-/m1/s1 |
| InChIKey | DSMIDRIKIGIMKK-CIDQBWSNSA-N |
| Literature Reference | K.INOUE,M.ONO,H.NAKAJIMA,I.FUJIE,H.INOUYE,T.FUJITA HETEROCYCLES,33,673(1992) |
| Solvent | Methanol-d4 |