EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C30H36O16 |
| Net Charge | 0 |
| Average Mass | 652.602 |
| Monoisotopic Mass | 652.20034 |
| SMILES | COc1cc(-c2cc(=O)c3c(O)cc(OC4OC(COC5OC(C)C(O)C(O)C5O)C(O)C(O)C4O)cc3o2)cc(OC)c1OC |
| InChI | InChI=1S/C30H36O16/c1-11-22(33)24(35)26(37)29(43-11)42-10-20-23(34)25(36)27(38)30(46-20)44-13-7-14(31)21-15(32)9-16(45-17(21)8-13)12-5-18(39-2)28(41-4)19(6-12)40-3/h5-9,11,20,22-27,29-31,33-38H,10H2,1-4H3 |
| InChIKey | QVXXLWMUTXHCGR-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ulmus parvifolia (ncbitaxon:63058) | |||
| bark (BTO:0001301) | MetaboLights (MTBLS4572) | ||
| seed (BTO:0001226) | MetaboLights (MTBLS4572) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3',4',5'-Trimethoxytricetin 7-[rhamnosyl-(1->6)-glucoside] (CHEBI:191729) is a flavonoids (CHEBI:72544) |
| 3',4',5'-Trimethoxytricetin 7-[rhamnosyl-(1->6)-glucoside] (CHEBI:191729) is a glycoside (CHEBI:24400) |
| IUPAC Name |
|---|
| 5-hydroxy-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one |
| Manual Xrefs | Databases |
|---|---|
| HMDB0035439 | HMDB |