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CHEBI:57933 - oleandomycin(1+)

Default Structure
ChEBI IDCHEBI:57933
ChEBI Nameoleandomycin(1+)
Stars
DefinitionThe conjugate acid of oleandomycin arising from protonation of the tertiary amino group; major species at pH 7.3.
Last Modified13 November 2017
DownloadsMolfile
FormulaC35H62NO12
Net Charge+1
Average Mass688.876
Monoisotopic Mass688.42665
SMILESCO[C@H]1C[C@H](O[C@H]2[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@H]([NH+](C)C)[C@H]3O)[C@@H](C)C[C@@]3(CO3)C(=O)[C@H](C)[C@@H](O)[C@@H](C)[C@@H](C)OC(=O)[C@@H]2C)O[C@@H](C)[C@@H]1O
InChIInChI=1S/C35H61NO12/c1-16-14-35(15-43-35)32(40)19(4)27(37)18(3)22(7)46-33(41)21(6)31(47-26-13-25(42-11)28(38)23(8)45-26)20(5)30(16)48-34-29(39)24(36(9)10)12-17(2)44-34/h16-31,34,37-39H,12-15H2,1-11H3/p+1/t16-,17+,18-,19+,20+,21+,22+,23-,24-,25-,26-,27-,28-,29+,30-,31-,34-,35+/m0/s1
InChIKeyRZPAKFUAFGMUPI-QESOVKLGSA-O
ChEBI Ontology
Outgoing Relation(s)
oleandomycin(1+) (CHEBI:57933) is a ammonium ion derivative (CHEBI:35274)
oleandomycin(1+) (CHEBI:57933) is conjugate acid of oleandomycin (CHEBI:16869)
Incoming Relation(s)
oleandomycin (CHEBI:16869) is conjugate base of oleandomycin(1+) (CHEBI:57933)
IUPAC Name 
(3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6-hydroxy-5,7,8,11,13,15-hexamethyl-4,10-dioxo-14-[3,4,6-trideoxy-3-(dimethylazaniumyl)-β-D-xylo-hexopyranosyloxy]-1,9-dioxaspiro[2.13]hexadec-12-yl 2,6-dideoxy-3-O-methyl-α-L-arabino-hexopyranoside
Synonyms  Source
oleandomycin cationChEBI
oleandomycin ionChEBI
UniProt Name  Source
oleandomycinUniProt