EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H22N2O2 |
| Net Charge | 0 |
| Average Mass | 298.386 |
| Monoisotopic Mass | 298.16813 |
| SMILES | [H]OC(=O)[C@@]([H])(N([H])C([H])([H])[C@@]([H])(N([H])[H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H] |
| InChI | InChI=1S/C18H22N2O2/c19-16(11-14-7-3-1-4-8-14)13-20-17(18(21)22)12-15-9-5-2-6-10-15/h1-10,16-17,20H,11-13,19H2,(H,21,22)/t16-,17-/m0/s1 |
| InChIKey | DOVYKTPJUZCUGU-IRXDYDNUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PHE-REDUCED-PHE (CHEBI:42652) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| N-[(2S)-2-amino-3-phenylpropyl]-L-phenylalanine | PDBeChem |
| PHE-REDUCED-PHE | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| FRF | PDBeChem |