| SpectraBase Spectrum ID |
CglN4k0ZZ6j |
| Name |
Methyl 2,3-dideoxy-2-N-ethylisonipecotate-4,6-O-(phenylmethylene)-3-C-phenylsulfonyl-.alpha.,D-glucopyranoside |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H35NO8S |
| InChI |
InChI=1S/C28H35NO8S/c1-3-34-26(30)19-14-16-29(17-15-19)23-25(38(31,32)21-12-8-5-9-13-21)24-22(36-28(23)33-2)18-35-27(37-24)20-10-6-4-7-11-20/h4-13,19,22-25,27-28H,3,14-18H2,1-2H3/t22-,23-,24-,25+,27-,28-/m1/s1 |
| InChIKey |
DQRBFSMXYGNWEF-UHFFFAOYSA-N |
| Molecular Weight |
545.647 g/mol |
| SMILES |
[C@]1(S(=O)(=O)c2ccccc2)([C@@]2(O[C@](c3ccccc3)(OC[C@]2(O[C@]([C@@]1(N1CCC(C(=O)OCC)CC1)[H])(OC)[H])[H])[H])[H])[H] |
| SPLASH |
splash10-0udi-0000900000-e473911140b249f3c196 |
| Source of Spectrum |
J-65-2641-6 |
| Wiley ID |
1532553 |
