EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H30N4O6S |
| Net Charge | 0 |
| Average Mass | 406.505 |
| Monoisotopic Mass | 406.18861 |
| SMILES | CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O |
| InChI | InChI=1S/C16H30N4O6S/c1-27-9-7-12(16(25)26)20-15(24)11(4-2-3-8-17)19-14(23)10(18)5-6-13(21)22/h10-12H,2-9,17-18H2,1H3,(H,19,23)(H,20,24)(H,21,22)(H,25,26)/t10-,11-,12-/m0/s1 |
| InChIKey | ZGEJRLJEAMPEDV-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) |
| Glu-Lys-Met (CHEBI:163079) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (4S)-4-amino-5-[[(2S)-6-amino-1-[[(1S)-1-carboxy-3-methylsulanylpropyl]amino]-1-oxohexan-2-yl]amino]-5-oxopentanoic acid |