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Substance Name: 4H-1-Benzopyran-6-acetic acid, alpha-ethyl-4-oxo-2-phenyl-3-(phenylmethoxy)-
RN: 173469-88-0
InChIKey: YTHOANFICVOVBU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H22-O5

Molecular Weight

  • 414.4548
 
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Names and Synonyms

Synonym

  • alpha-Ethyl-4-oxo-2-phenyl-3-(phenylmethoxy)-4H-1-benzopyran-6-acetic acid

Systematic Name

  • 4H-1-Benzopyran-6-acetic acid, alpha-ethyl-4-oxo-2-phenyl-3-(phenylmethoxy)-

Registry Numbers

CAS Registry Number

  • 173469-88-0

System Generated Number

  • 0173469880

Structure Descriptors

InChI

1S/C26H22O5/c1-2-20(26(28)29)19-13-14-22-21(15-19)23(27)25(30-16-17-9-5-3-6-10-17)24(31-22)18-11-7-4-8-12-18/h3-15,20H,2,16H2,1H3,(H,28,29)

InChIKey

YTHOANFICVOVBU-UHFFFAOYSA-N

Smiles

CCC(c1ccc2c(c1)c(=O)c(c(o2)c3ccccc3)OCc4ccccc4)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD unreported > 2gm/kg (2000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 34, Pg. 879, 1995.