EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H28N2O5 |
| Net Charge | 0 |
| Average Mass | 328.409 |
| Monoisotopic Mass | 328.19982 |
| SMILES | COCC(=O)N[C@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO |
| InChI | InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13+,14-/m1/s1 |
| InChIKey | DVRCOHXMQROJRA-HZSPNIEDSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3-oxanyl]-2-methoxyacetamide (CHEBI:118542) is a C-glycosyl compound (CHEBI:20857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-29991 | LINCS |