EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H23N3O4 |
| Net Charge | 0 |
| Average Mass | 309.366 |
| Monoisotopic Mass | 309.16886 |
| SMILES | [H]OC([H])([H])[C@@]1([H])N([H])[C@]([H])(C([H])([H])N([H])C(=O)c2c([H])c([H])c(N(C([H])([H])[H])C([H])([H])[H])c([H])c2[H])[C@@]([H])(O[H])[C@]1([H])O[H] |
| InChI | InChI=1S/C15H23N3O4/c1-18(2)10-5-3-9(4-6-10)15(22)16-7-11-13(20)14(21)12(8-19)17-11/h3-6,11-14,17,19-21H,7-8H2,1-2H3,(H,16,22)/t11-,12-,13-,14-/m1/s1 |
| InChIKey | OULLPOCYJLHTGG-AAVRWANBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-{[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]methyl}-4-(dimethylamino)benzamide (CHEBI:44059) is a benzamides (CHEBI:22702) |
| N-{[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]methyl}-4-(dimethylamino)benzamide (CHEBI:44059) is a dihydroxypyrrolidine (CHEBI:46776) |
| Synonyms | Source |
|---|---|
| N-{[(2R,3R,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PYRROLIDIN-2-YL]METHYL}-4-(DIMETHYLAMINO)BENZAMIDE | PDBeChem |
| N-{[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]methyl}-4-(dimethylamino)benzamide | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| MNI | PDBeChem |