EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H19NO2 |
| Net Charge | 0 |
| Average Mass | 197.278 |
| Monoisotopic Mass | 197.14158 |
| SMILES | [H]OC(=O)[C@@]1([H])N(C([H])([H])[H])C([H])([H])[C@@]2([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[C@@]2([H])C1([H])[H] |
| InChI | InChI=1S/C11H19NO2/c1-12-7-9-5-3-2-4-8(9)6-10(12)11(13)14/h8-10H,2-7H2,1H3,(H,13,14)/t8-,9+,10-/m0/s1 |
| InChIKey | YKQLYDHGCIEUMU-AEJSXWLSSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-METHYL-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID (CHEBI:42093) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| 2-METHYL-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID | PDBeChem |
| (3S,4aS,8aS)-2-methyldecahydroisoquinoline-3-carboxylic acid | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| DIQ | PDBeChem |