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CHEBI:205532 - Paecilomycin E

ChEBI IDCHEBI:205532
ChEBI NamePaecilomycin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26O7
Net Charge0
Average Mass366.410
Monoisotopic Mass366.16785
SMILESCOc1cc(O)c2c(c1)/C=C/C[C@H](O)[C@H](O)[C@@H](O)CCC[C@H](C)OC2=O
InChIInChI=1S/C19H26O7/c1-11-5-3-7-14(20)18(23)15(21)8-4-6-12-9-13(25-2)10-16(22)17(12)19(24)26-11/h4,6,9-11,14-15,18,20-23H,3,5,7-8H2,1-2H3/b6-4+/t11-,14-,15-,18+/m0/s1
InChIKeyVBHMOJMVNMGQQV-YEVUHLGXSA-N
Species of MetaboliteComponentSourceComments
Clavicipitaceaespecies SC0924 (ncbitaxon:1710628) - PubMed (20429578)
ChEBI Ontology
Outgoing Relation(s)
Paecilomycin E (CHEBI:205532) is a macrolide (CHEBI:25106)
IUPAC Name 
(4S,8S,9R,10S,12E)-8,9,10,18-tetrahydroxy-16-methoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraen-2-one
Manual XrefsDatabases
24668939ChemSpider