EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:201571 - Gentamicin C2a

ChEBI IDCHEBI:201571
ChEBI NameGentamicin C2a
Stars
Last Modified11 September 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H41N5O7
Net Charge0
Average Mass463.576
Monoisotopic Mass463.30060
SMILESCNC1C(O)C(OC2C(N)CC(N)C(OC3OC(C(C)N)CCC3N)C2O)OCC1(C)O
InChIInChI=1S/C20H41N5O7/c1-8(21)12-5-4-9(22)18(30-12)31-15-10(23)6-11(24)16(13(15)26)32-19-14(27)17(25-3)20(2,28)7-29-19/h8-19,25-28H,4-7,21-24H2,1-3H3
InChIKeyXUFIWSHGXVLULG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Gentamicin C2a (CHEBI:201571) is a amino cyclitol (CHEBI:61689)
Gentamicin C2a (CHEBI:201571) is a glycoside (CHEBI:24400)
Gentamicin C2a (CHEBI:201571) is conjugate base of gentamycin C2a (CHEBI:231950)
Incoming Relation(s)
gentamycin C2a (CHEBI:231950) is conjugate acid of Gentamicin C2a (CHEBI:201571)
IUPAC Name 
(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2R,3R,6S)-3-amino-6-[(1S)-1-aminoethyl]oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol
Manual XrefsDatabases
26354731ChemSpider
C21270KEGG COMPOUND