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CHEBI:191843 - Licorice glycoside D1
| Formula | C35H36O15 |
| Net Charge | 0 |
| Average Mass | 696.658 |
| Monoisotopic Mass | 696.20542 |
| SMILES | O=C(/C=C/c1ccc(O)cc1)OCC1(O)CO[C@@H](OC2[C@H](Oc3ccc([C@H]4CC(=O)c5ccc(O)cc5O4)cc3)OC(CO)[C@@H](O)[C@@H]2O)[C@H]1O |
| InChI | InChI=1S/C35H36O15/c36-15-27-29(41)30(42)31(50-34-32(43)35(44,17-46-34)16-45-28(40)12-3-18-1-6-20(37)7-2-18)33(49-27)47-22-9-4-19(5-10-22)25-14-24(39)23-11-8-21(38)13-26(23)48-25/h1-13,25,27,29-34,36-38,41-44H,14-17H2/b12-3+/t25-,27?,29-,30+,31?,32-,33-,34+,35?/m1/s1 |
| InChIKey | KDXWZGOCBQGWEB-ISCAJFQMSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ulmus parvifolia (ncbitaxon:63058) | |||
| seed (BTO:0001226) | MetaboLights (MTBLS4572) | ||
| bark (BTO:0001301) | MetaboLights (MTBLS4572) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Licorice glycoside D1 (CHEBI:191843) is a flavonoids (CHEBI:72544) |
| Licorice glycoside D1 (CHEBI:191843) is a glycoside (CHEBI:24400) |
| IUPAC Name |
|---|
| [(4S,5S)-5-[(2S,4S,5S)-4,5-dihydroxy-6-(hydroxymethyl)-2-[4-[(2R)-7-hydroxy-4-oxo-2,3-dihydrochromen-2-yl]phenoxy]oxan-3-yl]oxy-3,4-dihydroxyoxolan-3-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate |
| Manual Xrefs | Databases |
|---|---|
| 24846226 | ChemSpider |
| LMPK12140028 | LIPID MAPS |