EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H21N5O5 |
| Net Charge | 0 |
| Average Mass | 375.385 |
| Monoisotopic Mass | 375.15427 |
| SMILES | N[C@@H](Cc1cncn1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O |
| InChI | InChI=1S/C17H21N5O5/c18-13(6-11-7-19-9-21-11)16(25)20-8-15(24)22-14(17(26)27)5-10-1-3-12(23)4-2-10/h1-4,7,9,13-14,23H,5-6,8,18H2,(H,19,21)(H,20,25)(H,22,24)(H,26,27)/t13-,14-/m0/s1 |
| InChIKey | FZKFYOXDVWDELO-KBPBESRZSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| His-Gly-Tyr (CHEBI:164504) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid |