EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H22N4O7 |
| Net Charge | 0 |
| Average Mass | 382.373 |
| Monoisotopic Mass | 382.14885 |
| SMILES | NC(=O)C[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O |
| InChI | InChI=1S/C16H22N4O7/c17-10(6-13(18)23)14(24)19-11(5-8-1-3-9(22)4-2-8)15(25)20-12(7-21)16(26)27/h1-4,10-12,21-22H,5-7,17H2,(H2,18,23)(H,19,24)(H,20,25)(H,26,27)/t10-,11-,12-/m0/s1 |
| InChIKey | DPWDPEVGACCWTC-SRVKXCTJSA-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) |
| Asn-Tyr-Ser (CHEBI:160226) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoic acid |