EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H24N2O2.C20H24N2O2.C3H9O6P |
| Net Charge | 0 |
| Average Mass | 820.921 |
| Monoisotopic Mass | 820.38123 |
| SMILES | O=P(O)(O)OCC(O)CO.[H][C@@]12CCN(C[C@@H]1C=C)[C@]([H])([C@H](O)c1ccnc3ccc(OC)cc13)C2.[H][C@@]12CCN(C[C@@H]1C=C)[C@]([H])([C@H](O)c1ccnc3ccc(OC)cc13)C2 |
| InChI | InChI=1S/2C20H24N2O2.C3H9O6P/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;4-1-3(5)2-9-10(6,7)8/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;3-5H,1-2H2,(H2,6,7,8)/t2*13-,14-,19-,20+;/m00./s1 |
| InChIKey | YZDDKALBXAGVHK-VMJVVOMYSA-N |
| 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) |
| quinine glycerophosphate (CHEBI:755754) is a cinchona alkaloid (CHEBI:51323) |
| Synonyms | Source |
|---|---|
| Kineurine | ChEMBL |
| Quinine glycerophosphate | ChEMBL |