EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C27H30O14 |
| Net Charge | 0 |
| Average Mass | 578.523 |
| Monoisotopic Mass | 578.16356 |
| SMILES | C[C@@H]1OC(O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2c2c(O)cc3oc(-c4ccc(O)cc4)cc(=O)c3c2O)[C@H](O)[C@H](O)[C@H]1O |
| InChI | InChI=1S/C27H30O14/c1-9-19(32)22(35)24(37)27(38-9)41-26-23(36)20(33)16(8-28)40-25(26)18-13(31)7-15-17(21(18)34)12(30)6-14(39-15)10-2-4-11(29)5-3-10/h2-7,9,16,19-20,22-29,31-37H,8H2,1H3/t9-,16+,19-,20+,22+,23-,24+,25-,26+,27?/m0/s1 |
| InChIKey | BGPMMCPSTAYIEL-WDYJAFJFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| isovitexin 2''-O-rhamnoside (CHEBI:142906) has functional parent isovitexin (CHEBI:18330) |
| isovitexin 2''-O-rhamnoside (CHEBI:142906) is a flavone C-glycoside (CHEBI:83280) |
| isovitexin 2''-O-rhamnoside (CHEBI:142906) is a trihydroxyflavone (CHEBI:27116) |