EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H25N3O5 |
| Net Charge | 0 |
| Average Mass | 303.359 |
| Monoisotopic Mass | 303.17942 |
| SMILES | CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C |
| InChI | InChI=1S/C13H25N3O5/c1-6(2)9(14)12(19)15-8(5-17)11(18)16-10(7(3)4)13(20)21/h6-10,17H,5,14H2,1-4H3,(H,15,19)(H,16,18)(H,20,21)/t8-,9-,10-/m0/s1 |
| InChIKey | NZYNRRGJJVSSTJ-GUBZILKMSA-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-Ser-Val (CHEBI:166372) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-hydroxypropanoyl]amino]-3-methylbutanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 8578160 | ChemSpider |