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CHEBI:197247 - isorhamnetin 3-(4'''-p-coumarylrobinobioside)
| Formula | C37H38O18 |
| Net Charge | 0 |
| Average Mass | 770.693 |
| Monoisotopic Mass | 770.20581 |
| SMILES | COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](OC(=O)/C=C/c4ccc(O)cc4)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O |
| InChI | InChI=1S/C37H38O18/c1-15-33(54-25(42)10-5-16-3-7-18(38)8-4-16)30(46)32(48)36(51-15)50-14-24-27(43)29(45)31(47)37(53-24)55-35-28(44)26-21(41)12-19(39)13-23(26)52-34(35)17-6-9-20(40)22(11-17)49-2/h3-13,15,24,27,29-33,36-41,43,45-48H,14H2,1-2H3/b10-5+/t15-,24+,27-,29-,30-,31+,32+,33-,36+,37-/m0/s1 |
| InChIKey | BRALEKVBUFQYGS-HLYLUYEOSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Cannabis sativa (ncbitaxon:3483) | inflorescence (BTO:0000628) | MetaboLights (MTBLS6032) | Strain: Cannabis sativa var. DMG265 |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| isorhamnetin 3-(4'''-p-coumarylrobinobioside) (CHEBI:197247) is a flavonoids (CHEBI:72544) |
| isorhamnetin 3-(4'''-p-coumarylrobinobioside) (CHEBI:197247) is a glycoside (CHEBI:24400) |
| IUPAC Name |
|---|
| 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-3-yl 6-O-{6-deoxy-4-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-α-L-mannopyranosyl}-β-D-galactopyranoside |
| Manual Xrefs | Databases |
|---|---|
| 4952731 | ChemSpider |
| LMPK12112338 | LIPID MAPS |