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CHEBI:208320 - (E)-9-etheno-de-O-methyllasiodiplodin

ChEBI IDCHEBI:208320
ChEBI Name(E)-9-etheno-de-O-methyllasiodiplodin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H22O4
Net Charge0
Average Mass290.359
Monoisotopic Mass290.15181
SMILESCOc1cc(O)cc2c1C(=O)O[C@H](C)CCCCC/C=C/2
InChIInChI=1S/C17H22O4/c1-12-8-6-4-3-5-7-9-13-10-14(18)11-15(20-2)16(13)17(19)21-12/h7,9-12,18H,3-6,8H2,1-2H3/b9-7+/t12-/m1/s1
InChIKeyYAWRBFVZUNLSKO-YPUOHESYSA-N
Species of MetaboliteComponentSourceComments
Lasiodiplodia theobromae (ncbitaxon:45133) - DOI (10.1016/j.tetlet.2013.11.060)
ChEBI Ontology
Outgoing Relation(s)
(E)-9-etheno-de-O-methyllasiodiplodin (CHEBI:208320) is a macrolide (CHEBI:25106)
IUPAC Name 
(4R,10E)-14-hydroxy-16-methoxy-4-methyl-3-oxabicyclo[10.4.0]hexadeca-1(12),10,13,15-tetraen-2-one
Manual XrefsDatabases
78442760ChemSpider