EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H29NO2 |
| Net Charge | 0 |
| Average Mass | 243.391 |
| Monoisotopic Mass | 243.21983 |
| SMILES | [H]O[C@@]([H])([C@@]([H])(O[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])[C@@]([H])(N([H])[H])C([H])([H])C1([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H] |
| InChI | InChI=1S/C14H29NO2/c1-10(2)8-13(16)14(17)12(15)9-11-6-4-3-5-7-11/h10-14,16-17H,3-9,15H2,1-2H3/t12-,13-,14+/m0/s1 |
| InChIKey | KGYZGGUJJIVOQX-MELADBBJSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CYCLOHEXYLMETHYL-2,3-DIHYDROXY-5-METHYL-HEXYLAMIDE (CHEBI:46517) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| (2S,3R,4S)-2-amino-1-cyclohexyl-6-methylheptane-3,4-diol | PDBeChem |
| CYCLOHEXYLMETHYL-2,3-DIHYDROXY-5-METHYL-HEXYLAMIDE | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| XAO | PDBeChem |