EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H24N4O7S |
| Net Charge | 0 |
| Average Mass | 392.434 |
| Monoisotopic Mass | 392.13657 |
| SMILES | CSCC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O |
| InChI | InChI=1S/C14H24N4O7S/c1-26-5-4-8(17-12(22)7(15)2-3-11(20)21)13(23)18-9(14(24)25)6-10(16)19/h7-9H,2-6,15H2,1H3,(H2,16,19)(H,17,22)(H,18,23)(H,20,21)(H,24,25)/t7-,8-,9-/m0/s1 |
| InChIKey | NPMSEUWUMOSEFM-CIUDSAMLSA-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-Met-Asn (CHEBI:163099) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (4S)-4-amino-5-[[(2S)-1-[[(1S)-3-amino-1-carboxy-3-oxopropyl]amino]-4-methylsulanyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid |