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Substance Name: Salicylic acid, 4-(2-(3,6-dihydroxy-2-benzofuranyl)acetamido)-, 3,6-diacetate
RN: 60722-31-8
InChIKey: JDMLJCSPZDQPOX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H17-N-O9

Molecular Weight

  • 427.3633
 
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Names and Synonyms

Synonym

  • 4-(2-(3,6-Dihydroxy-2-benzofuranyl)acetamido)salicylic acid 3,6-diacetate

Systematic Name

  • Salicylic acid, 4-(2-(3,6-dihydroxy-2-benzofuranyl)acetamido)-, 3,6-diacetate

Registry Numbers

CAS Registry Number

  • 60722-31-8

System Generated Number

  • 0060722318

Structure Descriptors

InChI

1S/C21H17NO9/c1-10(23)29-13-4-6-15-17(8-13)31-18(20(15)30-11(2)24)9-19(26)22-12-3-5-14(21(27)28)16(25)7-12/h3-8,25H,9H2,1-2H3,(H,22,26)(H,27,28)

InChIKey

JDMLJCSPZDQPOX-UHFFFAOYSA-N

Smiles

CC(=O)Oc1ccc2c(c1)oc(c2OC(=O)C)CC(=O)Nc3ccc(c(c3)O)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1400mg/kg (1400mg/kg)   Archivum Immunologiae et Therapiae Experimentalis. Vol. 24, Pg. 603, 1976.