EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C17H22N4O5 |
| Net Charge | 0 |
| Average Mass | 362.386 |
| Monoisotopic Mass | 362.15902 |
| SMILES | C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O |
| InChI | InChI=1S/C17H22N4O5/c1-9(18)15(23)21-14(8-22)16(24)20-13(17(25)26)6-10-7-19-12-5-3-2-4-11(10)12/h2-5,7,9,13-14,19,22H,6,8,18H2,1H3,(H,20,24)(H,21,23)(H,25,26)/t9-,13-,14-/m0/s1 |
| InChIKey | UCDOXFBTMLKASE-HERUPUMHSA-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) |
| Ala-Ser-Trp (CHEBI:158515) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-hydroxypropanoyl]amino]-3-(1H-indol-3-yl)propanoic acid |