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CHEBI:190280 - 3''-Oxogentamicin A2

ChEBI IDCHEBI:190280
ChEBI Name3''-Oxogentamicin A2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H31N3O11
Net Charge0
Average Mass453.445
Monoisotopic Mass453.19586
SMILESN[C@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3OC[C@@H](O)C(=O)[C@H]3O)[C@H](N)C[C@@H]2N)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C17H31N3O11/c18-4-1-5(19)15(31-17-12(26)9(23)6(22)3-28-17)13(27)14(4)30-16-8(20)11(25)10(24)7(2-21)29-16/h4-8,10-17,21-22,24-27H,1-3,18-20H2/t4-,5+,6+,7+,8+,10+,11+,12+,13-,14+,15-,16+,17+/m0/s1
InChIKeyCFDCWVXMSQIKQJ-FHQZWOFOSA-N
Species of MetaboliteComponentSourceComments
Synechococcus elongatus PCC 7942 (ncbitaxon:32046) cell culture (BTO:0000214) MetaboLights (MTBLS2825)
ChEBI Ontology
Outgoing Relation(s)
3''-Oxogentamicin A2 (CHEBI:190280) is a amino cyclitol (CHEBI:61689)
3''-Oxogentamicin A2 (CHEBI:190280) is a glycoside (CHEBI:24400)
IUPAC Name 
(2R,3S,5R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-3,5-dihydroxyoxan-4-one
Manual XrefsDatabases
C21265KEGG COMPOUND