EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H28N4O6 |
| Net Charge | 0 |
| Average Mass | 432.477 |
| Monoisotopic Mass | 432.20088 |
| SMILES | CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1cnc2ccccc12)C(=O)O |
| InChI | InChI=1S/C21H28N4O6/c1-11(2)18(21(30)31)25-20(29)16(7-8-17(26)27)24-19(28)14(22)9-12-10-23-15-6-4-3-5-13(12)15/h3-6,10-11,14,16,18,23H,7-9,22H2,1-2H3,(H,24,28)(H,25,29)(H,26,27)(H,30,31)/t14-,16-,18-/m0/s1 |
| InChIKey | DVWAIHZOPSYMSJ-ZVZYQTTQSA-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-Glu-Val (CHEBI:164672) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (4S)-4-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-5-[[(1S)-1-carboxy-2-methylpropyl]amino]-5-oxopentanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 10149478 | ChemSpider |