| SpectraBase Compound ID | 4RfZnbSvhfk |
|---|---|
| InChI | InChI=1S/C16H19NO8/c1-23-15(22)8-5-7-3-2-4-9(11(7)17-8)24-16-14(21)13(20)12(19)10(6-18)25-16/h2-5,10,12-14,16-21H,6H2,1H3/t10-,12-,13+,14+,16-/m1/s1 |
| InChIKey | BMCAGUPUZJWNJO-FXBFXLCLSA-N |
| Mol Weight | 353.33 g/mol |
| Molecular Formula | C16H19NO8 |
| Exact Mass | 353.111067 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Hj1w5NY9F1n |
|---|---|
| Name | Methyl 7-(.beta.-D-Mannopyranosyloxy)-1H-indole-2-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H19NO8 |
| InChI | InChI=1S/C16H19NO8/c1-23-15(22)8-5-7-3-2-4-9(11(7)17-8)24-16-14(21)13(20)12(19)10(6-18)25-16/h2-5,10,12-14,16-21H,6H2,1H3/t10-,12-,13+,14+,16-/m1/s1 |
| InChIKey | BMCAGUPUZJWNJO-FXBFXLCLSA-N |
| Literature Reference DOI | 10.1002/cbdv.201300381 |
| Molecular Weight | 353.327 g/mol |
| SMILES | [nH]1c(cc2c1c(O[C@@]1(O[C@](CO)([C@]([C@@]([C@@]1(O)[H])(O)[H])(O)[H])[H])[H])ccc2)C(=O)OC |
| SPLASH | splash10-0a6r-6900000000-e591c8f71a639c81f365 |
| Source of Spectrum | CBD-11-973-1 |
| Synonyms | Methyl 7-(((2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1H-indole-2-carboxylate 7-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-1H-indole-2-carboxylic acid methyl ester Methyl 7-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1H-indole-2-carboxylate Methyl 7-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-1H-indole-2-carboxylate Methyl 7-[(2S,3S,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-1H-indole-2-carboxylate |
| Wiley ID | 1771432 |