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CHEBI:79574 - 2,2-dimethyl-3-(4-methoxyphenyl)-4-ethyl-2H-1-benzopyran-7-ol

ChEBI IDCHEBI:79574
ChEBI Name2,2-dimethyl-3-(4-methoxyphenyl)-4-ethyl-2H-1-benzopyran-7-ol
Stars
ASCII Name2,2-dimethyl-3-(4-methoxyphenyl)-4-ethyl-2H-1-benzopyran-7-ol
DefinitionA member of the class of chromenes that is 2H-1-benzopyran substituted by methyl groups at positions 2 and 2, an ethyl group at position 4, a hydroxy group at position 7 and a 4-methoxyphenyl group at position 3 respectively.
Last Modified23 June 2015
DownloadsMolfile
FormulaC20H22O3
Net Charge0
Average Mass310.393
Monoisotopic Mass310.15689
SMILESCCC1=C(c2ccc(OC)cc2)C(C)(C)Oc2cc(O)ccc21
InChIInChI=1S/C20H22O3/c1-5-16-17-11-8-14(21)12-18(17)23-20(2,3)19(16)13-6-9-15(22-4)10-7-13/h6-12,21H,5H2,1-4H3
InChIKeyYHXWLHMIDZAYPE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2,2-dimethyl-3-(4-methoxyphenyl)-4-ethyl-2H-1-benzopyran-7-ol (CHEBI:79574) is a chromenes (CHEBI:23232)
2,2-dimethyl-3-(4-methoxyphenyl)-4-ethyl-2H-1-benzopyran-7-ol (CHEBI:79574) is a monomethoxybenzene (CHEBI:25235)
2,2-dimethyl-3-(4-methoxyphenyl)-4-ethyl-2H-1-benzopyran-7-ol (CHEBI:79574) is a phenols (CHEBI:33853)
IUPAC Name 
4-ethyl-3-(4-methoxyphenyl)-2,2-dimethyl-2H-1-benzopyran-7-ol
Synonym  Source
4-ethyl-3-(4-methoxy-phenyl)-2,2-dimethyl-2H-chromen-7-olChEBI
Manual XrefsDatabases
C15054KEGG COMPOUND
Registry NumbersSources
Reaxys:1292561Reaxys