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CHEBI:79549 - 2,2-dimethyl-3,4-bis(4-methoxyphenyl)-2H-1-benzopyran-7-ol acetate

ChEBI IDCHEBI:79549
ChEBI Name2,2-dimethyl-3,4-bis(4-methoxyphenyl)-2H-1-benzopyran-7-ol acetate
Stars
ASCII Name2,2-dimethyl-3,4-bis(4-methoxyphenyl)-2H-1-benzopyran-7-ol acetate
DefinitionA member of the class of chromenes that is 2H-1-benzopyran-7-ol acetate substituted by methyl groups at positions 2 and 2 and a 4-methoxyphenyl group at positions 3 and 4 respectively.
Last Modified23 June 2015
DownloadsMolfile
FormulaC27H26O5
Net Charge0
Average Mass430.500
Monoisotopic Mass430.17802
SMILESCOc1ccc(C2=C(c3ccc(OC)cc3)C(C)(C)Oc3cc(OC(C)=O)ccc32)cc1
InChIInChI=1S/C27H26O5/c1-17(28)31-22-14-15-23-24(16-22)32-27(2,3)26(19-8-12-21(30-5)13-9-19)25(23)18-6-10-20(29-4)11-7-18/h6-16H,1-5H3
InChIKeyYKTJCZCEEMQPMI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2,2-dimethyl-3,4-bis(4-methoxyphenyl)-2H-1-benzopyran-7-ol acetate (CHEBI:79549) is a acetate ester (CHEBI:47622)
2,2-dimethyl-3,4-bis(4-methoxyphenyl)-2H-1-benzopyran-7-ol acetate (CHEBI:79549) is a chromenes (CHEBI:23232)
2,2-dimethyl-3,4-bis(4-methoxyphenyl)-2H-1-benzopyran-7-ol acetate (CHEBI:79549) is a monomethoxybenzene (CHEBI:25235)
IUPAC Name 
3,4-bis(4-methoxyphenyl)-2,2-dimethyl-2H-1-benzopyran-7-yl acetate
Synonym  Source
7-acetoxy-3,4-bis-(4-methoxy-phenyl)-2,2-dimethyl-2H-chromeneChEBI
Manual XrefsDatabases
C15027KEGG COMPOUND
Registry NumbersSources
Reaxys:1272577Reaxys