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CHEBI:86960 - veratrone acetate

ChEBI IDCHEBI:86960
ChEBI Nameveratrone acetate
Stars
DefinitionAn acetate ester obtained by the formal condensation of the hydroxy group of veratrone with acetic acid.
Last Modified27 July 2015
DownloadsMolfile
FormulaC20H22O7
Net Charge0
Average Mass374.389
Monoisotopic Mass374.13655
SMILESCOc1ccc(C(=O)C(COC(C)=O)Oc2ccccc2OC)cc1OC
InChIInChI=1S/C20H22O7/c1-13(21)26-12-19(27-17-8-6-5-7-15(17)23-2)20(22)14-9-10-16(24-3)18(11-14)25-4/h5-11,19H,12H2,1-4H3
InChIKeyODPYOMZIVHDXSD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
veratrone acetate (CHEBI:86960) has functional parent veratrone (CHEBI:86959)
veratrone acetate (CHEBI:86960) is a acetate ester (CHEBI:47622)
veratrone acetate (CHEBI:86960) is a aromatic ketone (CHEBI:76224)
veratrone acetate (CHEBI:86960) is a dimethoxybenzene (CHEBI:51681)
IUPAC Name 
3-(3,4-dimethoxyphenyl)-2-(2-methoxyphenoxy)-3-oxopropyl acetate