EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C19H24N4O7 |
| Net Charge | 0 |
| Average Mass | 420.422 |
| Monoisotopic Mass | 420.16450 |
| SMILES | N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O |
| InChI | InChI=1S/C19H24N4O7/c20-12(7-10-8-21-13-4-2-1-3-11(10)13)17(27)23-15(9-24)18(28)22-14(19(29)30)5-6-16(25)26/h1-4,8,12,14-15,21,24H,5-7,9,20H2,(H,22,28)(H,23,27)(H,25,26)(H,29,30)/t12-,14-,15-/m0/s1 |
| InChIKey | UIRPULWLRODAEQ-QEJZJMRPSA-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) |
| Trp-Ser-Glu (CHEBI:164839) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]pentanedioic acid |
| Manual Xrefs | Databases |
|---|---|
| 57545057 | ChemSpider |