EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H19AlF3N2O4 |
| Net Charge | -1 |
| Average Mass | 315.248 |
| Monoisotopic Mass | 315.11178 |
| SMILES | [H]OC(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[C@@]([H])(N([H])C(=O)[O][Al-]([F])([F])[F])[C@@]([H])(N([H])[H])C([H])([H])[H] |
| InChI | InChI=1S/C10H20N2O4.Al.3FH/c1-7(11)8(12-10(15)16)5-3-2-4-6-9(13)14;;;;/h7-8,12H,2-6,11H2,1H3,(H,13,14)(H,15,16);;3*1H/q;+3;;;/p-4/t7-,8+;;;;/m0..../s1 |
| InChIKey | YXYIADHJEQLYPU-JWQBCWJNSA-J |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 8-AMINO-7-CARBOXYAMINO-NONANOIC ACID WITH ALUMINUM FLUORIDE (CHEBI:47372) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| {(7R,8S)-8-amino-7-[(carboxy-kappaO)amino]nonanoato}(trifluoro)aluminate(1-) | PDBeChem |
| 8-AMINO-7-CARBOXYAMINO-NONANOIC ACID WITH ALUMINUM FLUORIDE | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| DAA | PDBeChem |