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CHEBI:27901 - podorhizol β-D-glucoside
| Formula | C28H34O13 |
| Net Charge | 0 |
| Average Mass | 578.567 |
| Monoisotopic Mass | 578.19994 |
| SMILES | [H][C@]1([C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2cc(OC)c(OC)c(OC)c2)C(=O)OC[C@@H]1Cc1ccc2c(c1)OCO2 |
| InChI | InChI=1S/C28H34O13/c1-34-18-8-14(9-19(35-2)26(18)36-3)25(41-28-24(32)23(31)22(30)20(10-29)40-28)21-15(11-37-27(21)33)6-13-4-5-16-17(7-13)39-12-38-16/h4-5,7-9,15,20-25,28-32H,6,10-12H2,1-3H3/t15-,20+,21-,22+,23-,24+,25+,28-/m0/s1 |
| InChIKey | IETDTZKBVWFSKR-XYEVPOBGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| podorhizol β-D-glucoside (CHEBI:27901) has functional parent podorhizol (CHEBI:37394) |
| podorhizol β-D-glucoside (CHEBI:27901) is a aromatic ether (CHEBI:35618) |
| podorhizol β-D-glucoside (CHEBI:27901) is a benzodioxoles (CHEBI:38298) |
| podorhizol β-D-glucoside (CHEBI:27901) is a benzyl alcohols (CHEBI:22743) |
| podorhizol β-D-glucoside (CHEBI:27901) is a β-D-glucoside (CHEBI:22798) |
| podorhizol β-D-glucoside (CHEBI:27901) is a γ-lactone (CHEBI:37581) |
| IUPAC Name |
|---|
| (S)-[(3S,4R)-4-(1,3-benzodioxol-5-ylmethyl)-2-oxotetrahydrofuran-3-yl](3,4,5-trimethoxyphenyl)methyl β-D-glucopyranoside |
| Synonym | Source |
|---|---|
| Podorhizol beta-D-glucoside | KEGG COMPOUND |