EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H13NO4 |
| Net Charge | 0 |
| Average Mass | 163.173 |
| Monoisotopic Mass | 163.08446 |
| SMILES | [H]OC([H])([H])[C@]1([H])N([H])[C@]([H])(C([H])([H])O[H])[C@@]([H])(O[H])[C@]1([H])O[H] |
| InChI | InChI=1S/C6H13NO4/c8-1-3-5(10)6(11)4(2-9)7-3/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1 |
| InChIKey | PFYHYHZGDNWFIF-JGWLITMVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2,5-dideoxy-2,5-imino-D-glucitol (CHEBI:42033) is a dihydroxypyrrolidine (CHEBI:46776) |
| Synonyms | Source |
|---|---|
| 2,5-DIDEOXY-2,5-IMINO-D-GLUCITOL | PDBeChem |
| (2R,3R,4R,5S)-2,5-bis(hydroxymethyl)pyrrolidine-3,4-diol | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| DIG | PDBeChem |