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CHEBI:65043 - 6'''-hydroxyneomycin C

ChEBI IDCHEBI:65043
ChEBI Name6'''-hydroxyneomycin C
Stars
DefinitionAn aminoglycoside derived from neomycin and consisting of neamine substituted at position 3 by a 2-amino-2-deoxy-α-D-glucopyranosyl-(1→3)-β-D-ribofuranosyl group.
Last Modified25 June 2012
SubmitterSteve
DownloadsMolfile
FormulaC23H45N5O14
Net Charge0
Average Mass615.634
Monoisotopic Mass615.29630
SMILESNC[C@H]1O[C@H](O[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4N)[C@H]3O)[C@@H](O)[C@H](N)C[C@@H]2N)[C@H](N)[C@@H](O)[C@@H]1O
InChIInChI=1S/C23H45N5O14/c24-2-7-13(32)15(34)10(27)21(37-7)40-18-6(26)1-5(25)12(31)20(18)42-23-17(36)19(9(4-30)39-23)41-22-11(28)16(35)14(33)8(3-29)38-22/h5-23,29-36H,1-4,24-28H2/t5-,6+,7-,8-,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+/m1/s1
InChIKeyLJQMKWFPBUGQOO-VZXHOKRSSA-N
ChEBI Ontology
Outgoing Relation(s)
6'''-hydroxyneomycin C (CHEBI:65043) is a aminoglycoside (CHEBI:47779)
6'''-hydroxyneomycin C (CHEBI:65043) is conjugate base of 6'''-hydroxyneomycin C(5+) (CHEBI:65031)
Incoming Relation(s)
6'''-hydroxyneomycin C(5+) (CHEBI:65031) is conjugate acid of 6'''-hydroxyneomycin C (CHEBI:65043)
IUPAC Name 
(1R,2R,3S,4R,6S)-4,6-diamino-2-{[3-O-(2-amino-2-deoxy-α-D-glucopyranosyl)-β-D-ribofuranosyl]oxy}-3-hydroxycyclohexyl 2,6-diamino-2,6-dideoxy-α-D-glucopyranoside
Synonym  Source
6'''-Deamino-6'''-hydroxyneomycin CKEGG COMPOUND
Manual XrefsDatabases
C17588KEGG COMPOUND
Registry NumbersSources
Reaxys:19612305Reaxys
Citations