![Methyl 6-O-(2,3,4-triacetoxy-5,6-dideoxy-L-[5'-deuterio]-lyxo-hexanoyl)-2,3-dimethoxy-.alpha.-D-glucopyranoside](/api/spectrum/AjsLgks4jnO/structure.png?h=300&w=458 "Methyl 6-O-(2,3,4-triacetoxy-5,6-dideoxy-L-[5'-deuterio]-lyxo-hexanoyl)-2,3-dimethoxy-.alpha.-D-glucopyranoside")
| SpectraBase Compound ID | EwEBGeuBL6S |
|---|---|
| InChI | InChI=1S/C21H34O13/c1-8-13(31-10(2)22)16(32-11(3)23)18(33-12(4)24)20(26)30-9-14-15(25)17(27-5)19(28-6)21(29-7)34-14/h13-19,21,25H,8-9H2,1-7H3/t13-,14+,15+,16+,17-,18+,19+,21-/m0/s1/i8D/t8?,13-,14+,15+,16+,17-,18+,19+,21- |
| InChIKey | PBKAQYOWLXESSZ-BSMFMONSSA-N |
| Mol Weight | 495.5 g/mol |
| Molecular Formula | C21H332DO13 |
| Exact Mass | 495.206218 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AjsLgks4jnO |
|---|---|
| Name | Methyl 6-O-(2,3,4-triacetoxy-5,6-dideoxy-L-[5'-deuterio]-lyxo-hexanoyl)-2,3-dimethoxy-.alpha.-D-glucopyranoside |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H33DO13 |
| InChI | InChI=1S/C21H34O13/c1-8-13(31-10(2)22)16(32-11(3)23)18(33-12(4)24)20(26)30-9-14-15(25)17(27-5)19(28-6)21(29-7)34-14/h13-19,21,25H,8-9H2,1-7H3/t13-,14+,15+,16+,17-,18+,19+,21-/m0/s1/i8D/t8?,13-,14+,15+,16+,17-,18+,19+,21- |
| InChIKey | PBKAQYOWLXESSZ-BSMFMONSSA-N |
| Molecular Weight | 495.496 g/mol |
| SMILES | O[C@]1([C@@]([C@@](OC)([C@](O[C@@]1(COC([C@@]([C@@]([C@@](OC(=O)C)(C([2D])C)[H])(OC(=O)C)[H])(OC(=O)C)[H])=O)[H])(OC)[H])[H])(OC)[H])[H] |
| SPLASH | splash10-000i-9310000000-2ef6e529e2671aafda9a |
| Source of Spectrum | QE-14-10379-39 |
| Wiley ID | 1692459 |