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Substance Name: BRN 0469969
RN: 23697-71-4
InChIKey: TYXZECYMDWIDOC-CPPKFOPJSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H30-Cl2-N2-O10

Molecular Weight

  • 661.488
 
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Names and Synonyms

Results Name

  • BRN 0469969

Synonym

  • BRN 0469969

Systematic Name

  • Pyrrole-2-carboxylic acid, 5-methyl-, 3'-ester with N-(7-((6-deoxy-4-O-methyl-5-C-methyl-alpha-L-lyxo-hexopyranosyl)oxy)-4-hydroxy-8-methyl-2-oxo-2H-benzopyran-7-yl)-2,6-dichlorobenzamide

Registry Numbers

CAS Registry Number

  • 23697-71-4

System Generated Number

  • 0023697714

Structure Descriptors

InChI

1S/C31H30Cl2N2O10/c1-13-9-11-18(34-13)28(39)44-25-23(37)30(45-31(3,4)26(25)41-5)42-19-12-10-15-22(36)21(29(40)43-24(15)14(19)2)35-27(38)20-16(32)7-6-8-17(20)33/h6-12,23,25-26,30,34,36-37H,1-5H3,(H,35,38)/t23-,25+,26-,30-/m1/s1

InChIKey

TYXZECYMDWIDOC-CPPKFOPJSA-N

Smiles

[nH]1c(C(=O)O[C@H]2[C@H]([C@@H](OC([C@@H]2OC)(C)C)Oc2ccc3c(c(c(oc3c2C)=O)NC(c2c(cccc2Cl)Cl)=O)O)O)ccc1C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 130mg/kg (130mg/kg)   "Structure-Activity Relationship among the Semisynthetic Antibiotics," Perlman, D., ed., New York, Academic Press, 1977Vol. -, Pg. 531, 1977.
mouse LD50 oral 940mg/kg (940mg/kg)   "Structure-Activity Relationship among the Semisynthetic Antibiotics," Perlman, D., ed., New York, Academic Press, 1977Vol. -, Pg. 531, 1977.