EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H23N3O8S |
| Net Charge | 0 |
| Average Mass | 393.418 |
| Monoisotopic Mass | 393.12059 |
| SMILES | CSCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O |
| InChI | InChI=1S/C14H23N3O8S/c1-26-5-4-8(14(24)25)16-13(23)9(6-11(20)21)17-12(22)7(15)2-3-10(18)19/h7-9H,2-6,15H2,1H3,(H,16,23)(H,17,22)(H,18,19)(H,20,21)(H,24,25)/t7-,8-,9-/m0/s1 |
| InChIKey | GZWOBWMOMPFPCD-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-Asp-Met (CHEBI:162786) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (4S)-4-amino-5-[[(2S)-3-carboxy-1-[[(1S)-1-carboxy-3-methylsulanylpropyl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid |