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CHEBI:204431 - methyl (2R,4R,6S,8E,11S)-6,7,15-trihydroxy-17-methoxy-11-methyl-13-oxo-3,12-dioxatricyclo[12.4.0.02,4]octadeca-1(14),8,15,17-tetraene-7-carboxylate

ChEBI IDCHEBI:204431
ChEBI Namemethyl (2R,4R,6S,8E,11S)-6,7,15-trihydroxy-17-methoxy-11-methyl-13-oxo-3,12-dioxatricyclo[12.4.0.02,4]octadeca-1(14),8,15,17-tetraene-7-carboxylate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24O9
Net Charge0
Average Mass408.403
Monoisotopic Mass408.14203
SMILESCOC(=O)C1(O)/C=C/C[C@H](C)OC(=O)c2c(O)cc(OC)cc2[C@H]2O[C@@H]2C[C@@H]1O
InChIInChI=1S/C20H24O9/c1-10-5-4-6-20(25,19(24)27-3)15(22)9-14-17(29-14)12-7-11(26-2)8-13(21)16(12)18(23)28-10/h4,6-8,10,14-15,17,21-22,25H,5,9H2,1-3H3/b6-4+/t10-,14+,15-,17+,20?/m0/s1
InChIKeyKFYHMUXHQAGCDJ-FZOJEAQZSA-N
Species of MetaboliteComponentSourceComments
Aigialus (ncbitaxon:193126) - DOI (10.1016/j.tet.2009.03.050)
ChEBI Ontology
Outgoing Relation(s)
methyl (2R,4R,6S,8E,11S)-6,7,15-trihydroxy-17-methoxy-11-methyl-13-oxo-3,12-dioxatricyclo[12.4.0.02,4]octadeca-1(14),8,15,17-tetraene-7-carboxylate (CHEBI:204431) is a macrolide (CHEBI:25106)
IUPAC Name 
methyl (2R,4R,6S,8E,11S)-6,7,15-trihydroxy-17-methoxy-11-methyl-13-oxo-3,12-dioxatricyclo[12.4.0.02,4]octadeca-1(14),8,15,17-tetraene-7-carboxylate
Manual XrefsDatabases
27024206ChemSpider