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| Formula | C21H29N5O5 |
| Net Charge | 0 |
| Average Mass | 431.493 |
| Monoisotopic Mass | 431.21687 |
| SMILES | CC(C)C[C@H](NC(=O)[C@H](Cc1cncn1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O |
| InChI | InChI=1S/C21H29N5O5/c1-12(2)7-18(21(30)31)26-20(29)17(9-14-10-23-11-24-14)25-19(28)16(22)8-13-3-5-15(27)6-4-13/h3-6,10-12,16-18,27H,7-9,22H2,1-2H3,(H,23,24)(H,25,28)(H,26,29)(H,30,31)/t16-,17-,18-/m0/s1 |
| InChIKey | FBHBVXUBTYVCRU-BZSNNMDCSA-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) |
| Tyr-His-Leu (CHEBI:165101) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 90637584 | ChemSpider |