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CHEBI:201667 - N-Desmethyl Clarithromycin

ChEBI IDCHEBI:201667
ChEBI NameN-Desmethyl Clarithromycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H67NO13
Net Charge0
Average Mass733.937
Monoisotopic Mass733.46124
SMILESCCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(NC)C2O)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O
InChIInChI=1S/C37H67NO13/c1-14-25-37(10,44)30(41)20(4)27(39)18(2)16-36(9,46-13)32(51-34-28(40)24(38-11)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-35(8,45-12)31(42)23(7)48-26/h18-26,28-32,34,38,40-42,44H,14-17H2,1-13H3
InChIKeyCIJTVUQEURKBDL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-Desmethyl Clarithromycin (CHEBI:201667) is a aminoglycoside (CHEBI:47779)
IUPAC Name 
(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-12,13-dihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-6-[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-(methylamino)oxan-2-yl]oxy-7-methoxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione
Manual XrefsDatabases
9247786ChemSpider