EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H22O9 |
| Net Charge | 0 |
| Average Mass | 418.398 |
| Monoisotopic Mass | 418.12638 |
| SMILES | C[C@@H]1O[C@@H](Oc2cc(O)cc3c2C(=O)C[C@@H](c2ccc(O)cc2)O3)[C@H](O)[C@H](O)[C@H]1O |
| InChI | InChI=1S/C21H22O9/c1-9-18(25)19(26)20(27)21(28-9)30-16-7-12(23)6-15-17(16)13(24)8-14(29-15)10-2-4-11(22)5-3-10/h2-7,9,14,18-23,25-27H,8H2,1H3/t9-,14-,18-,19+,20+,21-/m0/s1 |
| InChIKey | OVWZFLKQVPSRDZ-DUJSBPBCSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | feces (BTO:0000440) | MetaboLights (MTBLS5335) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Naringenin 5-rhamnoside (CHEBI:193229) is a flavonoids (CHEBI:72544) |
| Naringenin 5-rhamnoside (CHEBI:193229) is a glycoside (CHEBI:24400) |
| IUPAC Name |
|---|
| (2S)-7-hydroxy-2-(4-hydroxyphenyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3-dihydrochromen-4-one |
| Manual Xrefs | Databases |
|---|---|
| 30777192 | ChemSpider |
| HMDB0037581 | HMDB |