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CHEBI:145768 - apigenin-7-O-gentiobioside
| Formula | C27H30O15 |
| Net Charge | 0 |
| Average Mass | 594.522 |
| Monoisotopic Mass | 594.15847 |
| SMILES | O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12 |
| InChI | InChI=1S/C27H30O15/c28-8-17-20(32)22(34)24(36)26(41-17)38-9-18-21(33)23(35)25(37)27(42-18)39-12-5-13(30)19-14(31)7-15(40-16(19)6-12)10-1-3-11(29)4-2-10/h1-7,17-18,20-30,32-37H,8-9H2/t17-,18-,20-,21-,22+,23+,24-,25-,26-,27-/m1/s1 |
| InChIKey | XDMJJZUUHWWITI-IPOZFMEPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Helichrysum arenarium (ncbitaxon:261776) | flower (BTO:0000469) | PubMed (25921859) | |
| Lactuca sativa (ncbitaxon:4236) | leaf (BTO:0000713) | PubMed (27375675) |
| Roles Classification |
|---|
| Biological Role: | plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| apigenin-7-O-gentiobioside (CHEBI:145768) has functional parent apigenin (CHEBI:18388) |
| apigenin-7-O-gentiobioside (CHEBI:145768) has role plant metabolite (CHEBI:76924) |
| apigenin-7-O-gentiobioside (CHEBI:145768) is a dihydroxyflavone (CHEBI:38686) |
| apigenin-7-O-gentiobioside (CHEBI:145768) is a disaccharide derivative (CHEBI:63353) |
| apigenin-7-O-gentiobioside (CHEBI:145768) is a gentiobioside (CHEBI:24215) |
| apigenin-7-O-gentiobioside (CHEBI:145768) is a glycosyloxyflavone (CHEBI:50018) |
| IUPAC Name |
|---|
| 5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-β-D-glucopyranosyl-β-D-glucopyranoside |
| Synonyms | Source |
|---|---|
| apigenin 7-O-gentiobioside | ChEBI |
| apigenin 7-O-Glc-(1→6)-Glc | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| CPD-14824 | MetaCyc |
| Citations |
|---|