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CHEBI:190268 - 2'''-N-Acetyl-6'''-deamino-6'''-hydroxyparomomycin II

ChEBI IDCHEBI:190268
ChEBI Name2'''-N-Acetyl-6'''-deamino-6'''-hydroxyparomomycin II
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H46N4O16
Net Charge0
Average Mass658.655
Monoisotopic Mass658.29088
SMILESCC(=O)N[C@H]1[C@@H](O[C@H]2[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N)O[C@@H]2CO)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C25H46N4O16/c1-6(33)29-13-18(38)16(36)10(4-31)41-24(13)44-21-11(5-32)42-25(19(21)39)45-22-14(34)7(26)2-8(27)20(22)43-23-12(28)17(37)15(35)9(3-30)40-23/h7-25,30-32,34-39H,2-5,26-28H2,1H3,(H,29,33)/t7-,8+,9-,10-,11-,12-,13-,14+,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25+/m1/s1
InChIKeyBTGHERUFBGVQJR-KVQCZYKRSA-N
Species of MetaboliteComponentSourceComments
Synechococcus elongatus PCC 7942 (ncbitaxon:32046) cell culture (BTO:0000214) MetaboLights (MTBLS2825)
ChEBI Ontology
Outgoing Relation(s)
2'''-N-Acetyl-6'''-deamino-6'''-hydroxyparomomycin II (CHEBI:190268) is a 2-deoxystreptamine derivative (CHEBI:61800)
IUPAC Name 
N-[(2R,3R,4R,5S,6R)-2-[(2R,3S,4R,5S)-5-[(1R,2R,3S,5R,6S)-3,5-diamino-2-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-hydroxycyclohexyl]oxy-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Manual XrefsDatabases
C21261KEGG COMPOUND