EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H29N7O5 |
| Net Charge | 0 |
| Average Mass | 399.452 |
| Monoisotopic Mass | 399.22302 |
| SMILES | NC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)O |
| InChI | InChI=1S/C16H29N7O5/c17-9(5-6-12(18)24)13(25)22-10(3-1-7-21-16(19)20)14(26)23-8-2-4-11(23)15(27)28/h9-11H,1-8,17H2,(H2,18,24)(H,22,25)(H,27,28)(H4,19,20,21)/t9-,10-,11+/m0/s1 |
| InChIKey | XOKGKOQWADCLFQ-GARJFASQSA-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) |
| Gln-Arg-Pro (CHEBI:161928) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2R)-1-[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]pentanoyl]pyrrolidine-2-carboxylic acid |