CHEBI:57933 - oleandomycin(1+)

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ChEBI Name oleandomycin(1+)
ChEBI ID CHEBI:57933
Definition The conjugate acid of oleandomycin arising from protonation of the tertiary amino group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C35H62NO12
Net Charge +1
Average Mass 688.86630
Monoisotopic Mass 688.42665
InChI InChI=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
InChIKey RZPAKFUAFGMUPI-QESOVKLGSA-O
SMILES CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@H]1[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)[NH+](C)C)[C@@H](C)C[C@@]2(CO2)C(=O)[C@H](C)[C@@H](O)[C@@H](C)[C@@H](C)OC(=O)[C@@H]1C
ChEBI Ontology
Outgoing oleandomycin(1+) (CHEBI:57933) is a ammonium ion derivative (CHEBI:35274)
oleandomycin(1+) (CHEBI:57933) is conjugate acid of oleandomycin (CHEBI:16869)
Incoming 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 Sources
oleandomycin UniProt
oleandomycin cation ChEBI
oleandomycin ion ChEBI
Last Modified
13 November 2017