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Substance Name: 2H-1-Benzopyran-2-one, 7-methoxy-4-(4-(oxiranylmethoxy)phenyl)-3-phenyl-
RN: 111038-36-9
InChIKey: QIONRNLJAKNSBO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H20-O5

Molecular Weight

  • 400.428
 
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Names and Synonyms

Synonym

  • 7-Methoxy-4-(4-(oxiranylmethoxy)phenyl)-3-phenyl-2H-1-benzopyran-2-one

Systematic Name

  • 2H-1-Benzopyran-2-one, 7-methoxy-4-(4-(oxiranylmethoxy)phenyl)-3-phenyl-

Registry Numbers

CAS Registry Number

  • 111038-36-9

System Generated Number

  • 0111038369

Structure Descriptors

InChI

1S/C25H20O5/c1-27-19-11-12-21-22(13-19)30-25(26)24(16-5-3-2-4-6-16)23(21)17-7-9-18(10-8-17)28-14-20-15-29-20/h2-13,20H,14-15H2,1H3

InChIKey

QIONRNLJAKNSBO-UHFFFAOYSA-N

Smiles

COc1ccc2c(c1)oc(=O)c(c2c3ccc(cc3)OCC4CO4)c5ccccc5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 500mg/kg (500mg/kg)   Indian Journal of Pharmaceutical Sciences. Vol. 49, Pg. 43, 1987.