EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H21NO8 |
| Net Charge | 0 |
| Average Mass | 331.321 |
| Monoisotopic Mass | 331.12672 |
| SMILES | CC(=O)OCC1CC(OC(C)=O)C(/N=C(\C)O)C(OC(C)=O)O1 |
| InChI | InChI=1S/C14H21NO8/c1-7(16)15-13-12(21-9(3)18)5-11(6-20-8(2)17)23-14(13)22-10(4)19/h11-14H,5-6H2,1-4H3,(H,15,16) |
| InChIKey | QWKWYDSPCIKVNZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (5-acetamido-4,6-diacetyloxyoxan-2-yl)methyl acetate (CHEBI:235315) is a organic molecular entity (CHEBI:50860) |
| Synonym | Source |
|---|---|
| 4-deoxy-GlcNAc(Ac3) | SUBMITTER |
| Citations |
|---|