EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H15N5O4 |
| Net Charge | 0 |
| Average Mass | 293.283 |
| Monoisotopic Mass | 293.11240 |
| SMILES | [H]OC(=O)C([H])([H])N1C(=O)/C(=C(\[H])c2nc([H])n([H])c2[H])N=C1[C@@]([H])(N([H])[H])[C@]([H])(O[H])C([H])([H])[H] |
| InChI | InChI=1S/C12H15N5O4/c1-6(18)10(13)11-16-8(2-7-3-14-5-15-7)12(21)17(11)4-9(19)20/h2-3,5-6,10,18H,4,13H2,1H3,(H,14,15)(H,19,20)/b8-2-/t6-,10+/m1/s1 |
| InChIKey | DNKOENNEBPQUKF-GGQHHNJVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [2-(1-AMINO-2-HYDROXY-PROPYL)-4-(3H-IMIDAZOL-4-YLMETHYLENE)-5-OXO-4,5-DIHYDRO-IMIDAZOL-1-YL]-ACETIC ACID (CHEBI:41599) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| [2-(1-AMINO-2-HYDROXY-PROPYL)-4-(3H-IMIDAZOL-4-YLMETHYLENE)-5-OXO-4,5-DIHYDRO-IMIDAZOL-1-YL]-ACETIC ACID | PDBeChem |
| [(4Z)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-(1H-imidazol-4-ylmethylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| CRG | PDBeChem |