EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H38N10O4 |
| Net Charge | 0 |
| Average Mass | 458.568 |
| Monoisotopic Mass | 458.30775 |
| SMILES | NCCCC[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)O |
| InChI | InChI=1S/C18H38N10O4/c19-8-2-1-6-13(16(31)32)28-15(30)12(7-4-10-26-18(23)24)27-14(29)11(20)5-3-9-25-17(21)22/h11-13H,1-10,19-20H2,(H,27,29)(H,28,30)(H,31,32)(H4,21,22,25)(H4,23,24,26)/t11-,12-,13-/m0/s1 |
| InChIKey | HJVGMOYJDDXLMI-AVGNSLFASA-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) |
| Arg-Arg-Lys (CHEBI:158743) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 16568809 | ChemSpider |