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CHEBI:172916 - 6'-Oxo-G418

ChEBI IDCHEBI:172916
ChEBI Name6'-Oxo-G418
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H38N4O10
Net Charge0
Average Mass494.542
Monoisotopic Mass494.25879
SMILESCN[C@@H]1[C@@H](O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3O[C@H](C(C)=O)[C@@H](O)[C@H](O)[C@H]3N)[C@@H](N)C[C@H]2N)OC[C@]1(C)O
InChIInChI=1S/C20H38N4O10/c1-6(25)14-11(27)10(26)9(23)18(32-14)33-15-7(21)4-8(22)16(12(15)28)34-19-13(29)17(24-3)20(2,30)5-31-19/h7-19,24,26-30H,4-5,21-23H2,1-3H3/t7-,8+,9+,10+,11-,12-,13+,14+,15+,16-,17+,18+,19+,20-/m0/s1
InChIKeyKUVREGBJSDRYBS-CYLNMLNUSA-N
Species of MetaboliteComponentSourceComments
Gallus gallus (ncbitaxon:9031) blood plasma (BTO:0000131) MetaboLights (MTBLS1274)
ChEBI Ontology
Outgoing Relation(s)
6'-Oxo-G418 (CHEBI:172916) is a amino cyclitol (CHEBI:61689)
6'-Oxo-G418 (CHEBI:172916) is a glycoside (CHEBI:24400)
IUPAC Name 
1-[(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-dihydroxyoxan-2-yl]ethanone
Manual XrefsDatabases
C21268KEGG COMPOUND