EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H22N4O7 |
| Net Charge | 0 |
| Average Mass | 406.395 |
| Monoisotopic Mass | 406.14885 |
| SMILES | N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O |
| InChI | InChI=1S/C18H22N4O7/c19-11(5-9-7-20-12-4-2-1-3-10(9)12)16(26)22-14(8-23)17(27)21-13(18(28)29)6-15(24)25/h1-4,7,11,13-14,20,23H,5-6,8,19H2,(H,21,27)(H,22,26)(H,24,25)(H,28,29)/t11-,13-,14-/m0/s1 |
| InChIKey | RNDWCRUOGGQDKN-UBHSHLNASA-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) |
| Trp-Ser-Asp (CHEBI:164836) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]butanedioic acid |