EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H18N4O4 |
| Net Charge | 0 |
| Average Mass | 246.267 |
| Monoisotopic Mass | 246.13281 |
| SMILES | CC(NC(CCCN=C(N)N)C(=O)O)C(=O)O |
| InChI | InChI=1S/C9H18N4O4/c1-5(7(14)15)13-6(8(16)17)3-2-4-12-9(10)11/h5-6,13H,2-4H2,1H3,(H,14,15)(H,16,17)(H4,10,11,12) |
| InChIKey | IMXSCCDUAFEIOE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(Amidinoamino)-2-[(carboxyethyl)amino]pentanoic acid (CHEBI:182149) is a alanine derivative (CHEBI:22278) |
| IUPAC Name |
|---|
| 2-(1-carboxyethylamino)-5-(diaminomethylideneamino)pentanoic acid |