EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H21N5O6 |
| Net Charge | 0 |
| Average Mass | 331.329 |
| Monoisotopic Mass | 331.14918 |
| SMILES | NC(=O)CC[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)NCC(=O)O |
| InChI | InChI=1S/C12H21N5O6/c13-6(1-3-8(14)18)11(22)17-7(2-4-9(15)19)12(23)16-5-10(20)21/h6-7H,1-5,13H2,(H2,14,18)(H2,15,19)(H,16,23)(H,17,22)(H,20,21)/t6-,7-/m0/s1 |
| InChIKey | NVEASDQHBRZPSU-BQBZGAKWSA-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-Gln-Gly (CHEBI:162074) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| 2-[[(2S)-5-amino-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]acetic acid |