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Substance Name: 2H-1-Benzopyran, 7-methoxy-2,2-dimethyl-4-(4-(oxiranylmethoxy)phenyl)-3-phenyl-
RN: 111038-40-5
InChIKey: IVLNPXSDNHOUEG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H26-O4

Molecular Weight

  • 414.4984
 
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Names and Synonyms

Synonyms

  • 2,2-Dimethyl-3-phenyl-4-(p-(2,3-epoxypropyloxy)phenyl)-7-methoxychromene
  • 7-Methoxy-2,2-dimethyl-4-(4-(oxiranylmethoxy)phenyl)-3-phenyl-2H-1-benzopyran

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 111038-40-5

System Generated Number

  • 0111038405

Structure Descriptors

InChI

1S/C27H26O4/c1-27(2)26(19-7-5-4-6-8-19)25(23-14-13-21(28-3)15-24(23)31-27)18-9-11-20(12-10-18)29-16-22-17-30-22/h4-15,22H,16-17H2,1-3H3

InChIKey

IVLNPXSDNHOUEG-UHFFFAOYSA-N

Smiles

CC1(C(=C(c2ccc(cc2O1)OC)c3ccc(cc3)OCC4CO4)c5ccccc5)C

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.