EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H20N4O4S |
| Net Charge | 0 |
| Average Mass | 364.427 |
| Monoisotopic Mass | 364.12053 |
| SMILES | N[C@@H](CS)C(=O)NCC(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O |
| InChI | InChI=1S/C16H20N4O4S/c17-11(8-25)15(22)19-7-14(21)20-13(16(23)24)5-9-6-18-12-4-2-1-3-10(9)12/h1-4,6,11,13,18,25H,5,7-8,17H2,(H,19,22)(H,20,21)(H,23,24)/t11-,13-/m0/s1 |
| InChIKey | JDHMXPSXWMPYQZ-AAEUAGOBSA-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) |
| Cys-Gly-Trp (CHEBI:161375) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoic acid |