EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H24N6O5 |
| Net Charge | 0 |
| Average Mass | 332.361 |
| Monoisotopic Mass | 332.18082 |
| SMILES | C[C@@H](O)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)CN)C(=O)O |
| InChI | InChI=1S/C12H24N6O5/c1-6(19)9(11(22)23)18-10(21)7(17-8(20)5-13)3-2-4-16-12(14)15/h6-7,9,19H,2-5,13H2,1H3,(H,17,20)(H,18,21)(H,22,23)(H4,14,15,16)/t6-,7+,9+/m1/s1 |
| InChIKey | DTPOVRRYXPJJAZ-FJXKBIBVSA-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-Arg-Thr (CHEBI:163476) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S,3R)-2-[[(2S)-2-[(2-aminoacetyl)amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxybutanoic acid |