EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H17N3O7 |
| Net Charge | 0 |
| Average Mass | 291.260 |
| Monoisotopic Mass | 291.10665 |
| SMILES | C[C@@H](O)[C@H](NC(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)O |
| InChI | InChI=1S/C10H17N3O7/c1-4(14)8(13-6(15)3-11)9(18)12-5(10(19)20)2-7(16)17/h4-5,8,14H,2-3,11H2,1H3,(H,12,18)(H,13,15)(H,16,17)(H,19,20)/t4-,5+,8+/m1/s1 |
| InChIKey | NVTPVQLIZCOJFK-FOHZUACHSA-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) |
| Gly-Thr-Asp (CHEBI:164033) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S,3R)-2-[(2-aminoacetyl)amino]-3-hydroxybutanoyl]amino]butanedioic acid |