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CHEBI:63311 - mycinamicin VI(1+)

Default Structure
ChEBI IDCHEBI:63311
ChEBI Namemycinamicin VI(1+)
Stars
DefinitionA mycinamicin cation that is the conjugate acid of mycinamicin VI, obtained by protnation of the tertiary amino group.
Last Modified1 December 2011
SubmitterSteve
DownloadsMolfile
FormulaC35H58NO11
Net Charge+1
Average Mass668.845
Monoisotopic Mass668.40044
SMILESCC[C@H]1OC(=O)/C=C/[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H]([NH+](C)C)[C@H]2O)[C@@H](C)C[C@@H](C)C(=O)/C=C/C=C/[C@@H]1CO[C@@H]1O[C@H](C)[C@@H](O)[C@@H](O)[C@H]1O
InChIInChI=1S/C35H57NO11/c1-9-27-24(18-43-34-32(42)31(41)29(39)23(6)45-34)12-10-11-13-26(37)20(3)16-21(4)33(19(2)14-15-28(38)46-27)47-35-30(40)25(36(7)8)17-22(5)44-35/h10-15,19-25,27,29-35,39-42H,9,16-18H2,1-8H3/p+1/b12-10+,13-11+,15-14+/t19-,20+,21-,22+,23+,24+,25-,27+,29+,30+,31+,32+,33+,34+,35-/m0/s1
InChIKeyORPUAOXOPLNKNG-GEUQSOIWSA-O
ChEBI Ontology
Outgoing Relation(s)
mycinamicin VI(1+) (CHEBI:63311) is a mycinamicin cation (CHEBI:63309)
IUPAC Name 
[(2R,3R,4E,6E,9R,11S,12S,13S,14E)-2-ethyl-9,11,13-trimethyl-8,16-dioxo-12-{[3,4,6-trideoxy-3-(dimethylazaniumyl)-β-D-xylo-hexopyranosyl]oxy}oxacyclohexadeca-4,6,14-trien-3-yl]methyl 6-deoxy-β-D-allopyranoside
Synonym  Source
mycinamicin VI cationChEBI
UniProt Name  Source
mycinamicin VIUniProt