EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H15NO3 |
| Net Charge | 0 |
| Average Mass | 185.223 |
| Monoisotopic Mass | 185.10519 |
| SMILES | CC(C)=CC(=O)[C@@H]([NH3+])CCC(=O)[O-] |
| InChI | InChI=1S/C9H15NO3/c1-6(2)5-8(11)7(10)3-4-9(12)13/h5,7H,3-4,10H2,1-2H3,(H,12,13)/t7-/m0/s1 |
| InChIKey | FAZUJKDKBITMIB-ZETCQYMHSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (4S)-4-ammonio-7-methyl-5-oxooct-6-enoate (CHEBI:232025) is a carboxylic acid anion (CHEBI:29067) |
| UniProt Name | Source |
|---|---|
| (4S)-4-amino-7-methyl-5-oxooct-6-enoate | UniProt |
| Citations |
|---|