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CHEBI:77352 - methymycin(1+)

ChEBI IDCHEBI:77352
ChEBI Namemethymycin(1+)
Stars
DefinitionAn organic cation that is the conjugate acid of methymycin, obtained by protonation of the tertiary amino group; major species at pH 7.3.
Last Modified11 March 2014
SubmitterKAX
DownloadsMolfile
FormulaC25H44NO7
Net Charge+1
Average Mass470.627
Monoisotopic Mass470.31123
SMILESCC[C@H]1OC(=O)[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@]1(C)O
InChIInChI=1S/C25H43NO7/c1-9-20-25(6,30)11-10-19(27)14(2)12-15(3)22(17(5)23(29)32-20)33-24-21(28)18(26(7)8)13-16(4)31-24/h10-11,14-18,20-22,24,28,30H,9,12-13H2,1-8H3/p+1/b11-10+/t14-,15+,16-,17-,18+,20-,21-,22+,24+,25+/m1/s1
InChIKeyHUKYPYXOBINMND-HYUJHOPRSA-O
ChEBI Ontology
Outgoing Relation(s)
methymycin(1+) (CHEBI:77352) is a ammonium ion derivative (CHEBI:35274)
methymycin(1+) (CHEBI:77352) is a organic cation (CHEBI:25697)
methymycin(1+) (CHEBI:77352) is conjugate acid of methymycin (CHEBI:29630)
Incoming Relation(s)
methymycin (CHEBI:29630) is conjugate base of methymycin(1+) (CHEBI:77352)
IUPAC Name 
(3R,4S,5S,7R,9E,11S,12R)-12-ethyl-11-hydroxy-3,5,7,11-tetramethyl-2,8-dioxooxacyclododec-9-en-4-yl 3,4,6-trideoxy-3-(dimethylazaniumyl)-β-D-xylo-hexopyranoside
UniProt Name  Source
methymycinUniProt
Manual XrefsDatabases
CPD-13832MetaCyc
Citations