| SpectraBase Compound ID | 4vGwqKWQ6fJ |
|---|---|
| InChI | InChI=1S/C23H27NO7/c1-29-22-15(30-23-21(28)20(27)19(26)16(10-25)31-23)9-12-6-7-24-14-8-11-4-2-3-5-13(11)18(22)17(12)14/h2-5,9,14,16,19-21,23-28H,6-8,10H2,1H3/t14?,16-,19-,20+,21-,23-/m1/s1 |
| InChIKey | PPZMUQMLULQLGP-GOCWHLTOSA-N |
| Mol Weight | 429.47 g/mol |
| Molecular Formula | C23H27NO7 |
| Exact Mass | 429.178752 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GBbequ6wjNu |
|---|---|
| Name | Asimilobine-2-O-.beta.-D-glucoside |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H27NO7 |
| InChI | InChI=1S/C23H27NO7/c1-29-22-15(30-23-21(28)20(27)19(26)16(10-25)31-23)9-12-6-7-24-14-8-11-4-2-3-5-13(11)18(22)17(12)14/h2-5,9,14,16,19-21,23-28H,6-8,10H2,1H3/t14?,16-,19-,20+,21-,23-/m1/s1 |
| InChIKey | PPZMUQMLULQLGP-GOCWHLTOSA-N |
| Molecular Weight | 429.469 g/mol |
| SMILES | O[C@@]1([C@]([C@](Oc2c(c3-c4c(CC5c3c(CCN5)c2)cccc4)OC)(O[C@@]([C@]1(O)[H])(CO)[H])[H])(O)[H])[H] |
| SPLASH | splash10-014i-0390000000-502d64c62dbe3f4c5fee |
| Source of Spectrum | X2-56-1476-2 |
| Wiley ID | 1605067 |