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| Formula | C21H28N4O4 |
| Net Charge | 0 |
| Average Mass | 400.479 |
| Monoisotopic Mass | 400.21106 |
| SMILES | CC(C)[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N1CCC[C@@H]1C(=O)O |
| InChI | InChI=1S/C21H28N4O4/c1-12(2)18(22)19(26)24-16(20(27)25-9-5-8-17(25)21(28)29)10-13-11-23-15-7-4-3-6-14(13)15/h3-4,6-7,11-12,16-18,23H,5,8-10,22H2,1-2H3,(H,24,26)(H,28,29)/t16-,17+,18-/m0/s1 |
| InChIKey | AYHNXCJKBLYVOA-KSZLIROESA-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) |
| Val-Trp-Pro (CHEBI:166407) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2R)-1-[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carboxylic acid |