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CHEBI:69814 - isovitexin 8-C-β-glucoside
| Formula | C27H30O15 |
| Net Charge | 0 |
| Average Mass | 594.522 |
| Monoisotopic Mass | 594.15847 |
| SMILES | O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12 |
| InChI | InChI=1S/C27H30O15/c28-6-12-17(32)21(36)23(38)26(41-12)15-19(34)14-10(31)5-11(8-1-3-9(30)4-2-8)40-25(14)16(20(15)35)27-24(39)22(37)18(33)13(7-29)42-27/h1-5,12-13,17-18,21-24,26-30,32-39H,6-7H2/t12-,13-,17-,18-,21+,22+,23-,24-,26+,27+/m1/s1 |
| InChIKey | FIAAVMJLAGNUKW-VQVVXJKKSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Passiflora edulis (ncbitaxon:78168) | - | PubMed (21608987) | |
| Urtica circularis (IPNI:260621-2) | aerial part (BTO:0001658) | PubMed (21608987) | 80% ethanolic extract of dried, powdered aerial parts |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| isovitexin 8-C-β-glucoside (CHEBI:69814) has functional parent isovitexin (CHEBI:18330) |
| isovitexin 8-C-β-glucoside (CHEBI:69814) has role metabolite (CHEBI:25212) |
| isovitexin 8-C-β-glucoside (CHEBI:69814) is a C-glycosyl compound (CHEBI:20857) |
| isovitexin 8-C-β-glucoside (CHEBI:69814) is a trihydroxyflavone (CHEBI:27116) |
| IUPAC Name |
|---|
| 5,7-dihydroxy-2-(4-hydroxyphenyl)-6,8-bis[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]-4H-chromen-4-one |
| Synonyms | Source |
|---|---|
| apigenin-6,8-di-C-glycopyranoside | ChEBI |
| Vicenin-2 | KEGG COMPOUND |
| 5,7,4'-Trihydroxyflavone-6,8-di-C-glucoside | KEGG COMPOUND |
| Apigenin-6,8-di-C-glycoside | KEGG COMPOUND |
| isovitexin 8-C-glucoside | ChEBI |
| apigenin-6,8-C-diglucoside | ChEBI |