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Substance Name: 2H-1-Benzopyran, 7-methoxy-2,2-dimethyl-3-phenyl-4-(4-(2-propenyloxy)phenyl)-
RN: 123886-63-5
InChIKey: DMQBARJBKYJCSC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H26-O3

Molecular Weight

  • 398.4994
 
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Names and Synonyms

Synonym

  • 7-Methoxy-2,2-dimethyl-3-phenyl-4-(4-(2-propenyloxy)phenyl)-2H-1-benzopyran

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 123886-63-5

System Generated Number

  • 0123886635

Structure Descriptors

InChI

1S/C27H26O3/c1-5-17-29-21-13-11-19(12-14-21)25-23-16-15-22(28-4)18-24(23)30-27(2,3)26(25)20-9-7-6-8-10-20/h5-16,18H,1,17H2,2-4H3

InChIKey

DMQBARJBKYJCSC-UHFFFAOYSA-N

Smiles

CC1(C(=C(c2ccc(cc2O1)OC)c3ccc(cc3)OCC=C)c4ccccc4)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. 51, Pg. 48, 1989.
rat LD50 oral 500mg/kg (500mg/kg)   Indian Journal of Pharmaceutical Sciences. Vol. 51, Pg. 48, 1989.