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Substance Name: Chromone, 6-hexyl-7-hydroxy-3-(2-methylthiazol-4-yl)-, acetate (ester)
RN: 80761-87-1
InChIKey: GDFSQAOVDMJYCK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-N-O4-S

Molecular Weight

  • 385.4817
 
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Names and Synonyms

Synonyms

  • 3-(2-Methyl-4-thiazolyl)-6-hexyl-7-acetoxychromanone
  • 4H-1-Benzopyran-4-one, 7-(acetyloxy)-6-hexyl-3-(2-methyl-4-thiazolyl)-
  • 6-Hexyl-7-hydroxy-3-(2-methylthiazol-4-yl)chromone acetate (ester)
  • BRN 5136292

Systematic Name

  • Chromone, 6-hexyl-7-hydroxy-3-(2-methylthiazol-4-yl)-, acetate (ester)

Registry Numbers

CAS Registry Number

  • 80761-87-1

System Generated Number

  • 0080761871

Structure Descriptors

InChI

1S/C21H23NO4S/c1-4-5-6-7-8-15-9-16-20(10-19(15)26-14(3)23)25-11-17(21(16)24)18-12-27-13(2)22-18/h9-12H,4-8H2,1-3H3

InChIKey

GDFSQAOVDMJYCK-UHFFFAOYSA-N

Smiles

CCCCCCc1cc2c(cc1OC(=O)C)occ(c2=O)c3csc(n3)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 3gm/kg (3000mg/kg)   Pharmaceutical Chemistry Journal Vol. 15, Pg. 780, 1981.