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CHEBI:216742 - 7-O-methylaposphaerin C

ChEBI IDCHEBI:216742
ChEBI Name7-O-methylaposphaerin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H20O5
Net Charge0
Average Mass304.342
Monoisotopic Mass304.13107
SMILESCCCC=C[C@@H]1CC(=O)c2c(CC(=O)O)cc(OC)cc2O1
InChIInChI=1S/C17H20O5/c1-3-4-5-6-12-9-14(18)17-11(8-16(19)20)7-13(21-2)10-15(17)22-12/h5-7,10,12H,3-4,8-9H2,1-2H3,(H,19,20)/t12-/m1/s1
InChIKeyCGPPZSINVWDEIM-GFCCVEGCSA-N
Species of MetaboliteComponentSourceComments
Didymosphaeria (ncbitaxon:85947) - DOI (10.1016/j.tet.2020.131497)
ChEBI Ontology
Outgoing Relation(s)
7-O-methylaposphaerin C (CHEBI:216742) is a chromones (CHEBI:23238)
IUPAC Name 
2-[(2S)-7-methoxy-4-oxo-2-pent-1-enyl-2,3-dihydrochromen-5-yl]acetic acid