EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H36N4O10 |
| Net Charge | 0 |
| Average Mass | 480.515 |
| Monoisotopic Mass | 480.24314 |
| SMILES | CN[C@@H]1[C@@H](O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3O[C@H](C=O)[C@@H](O)[C@H](O)[C@H]3N)[C@@H](N)C[C@H]2N)OC[C@]1(C)O |
| InChI | InChI=1S/C19H36N4O10/c1-19(29)5-30-18(13(28)16(19)23-2)33-15-7(21)3-6(20)14(12(15)27)32-17-9(22)11(26)10(25)8(4-24)31-17/h4,6-18,23,25-29H,3,5,20-22H2,1-2H3/t6-,7+,8+,9+,10+,11+,12-,13+,14+,15-,16+,17+,18+,19-/m0/s1 |
| InChIKey | JOPRNRFTSWVXKB-ZFAMMYHGSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Synechococcus elongatus PCC 7942 (ncbitaxon:32046) | cell culture (BTO:0000214) | MetaboLights (MTBLS2825) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6'-Oxogentamicin X2 (CHEBI:190267) is a amino cyclitol (CHEBI:61689) |
| 6'-Oxogentamicin X2 (CHEBI:190267) is a glycoside (CHEBI:24400) |
| IUPAC Name |
|---|
| (2S,3S,4R,5R,6S)-5-amino-6-[(1R,2S,3S,4R,6S)-4,6-diamino-3-[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-3,4-dihydroxyoxane-2-carbaldehyde |
| Manual Xrefs | Databases |
|---|---|
| C21267 | KEGG COMPOUND |