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Substance Name: beta-D-Xylopyranoside, 4-((2-chlorophenyl)methyl)phenyl
RN: 147029-85-4
InChIKey: FYXYGJIPESPIQM-XDNAFOTISA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H19-Cl-O5

Molecular Weight

  • 350.7961
 
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Names and Synonyms

Synonym

  • 4-(2-Chlorobenzyl)phenyl-beta-D-xylopyranoside

Systematic Name

  • beta-D-Xylopyranoside, 4-((2-chlorophenyl)methyl)phenyl

Registry Numbers

CAS Registry Number

  • 147029-85-4

System Generated Number

  • 0147029854

Structure Descriptors

InChI

1S/C18H19ClO5/c19-14-4-2-1-3-12(14)9-11-5-7-13(8-6-11)24-18-17(22)16(21)15(20)10-23-18/h1-8,15-18,20-22H,9-10H2/t15-,16+,17-,18+/m1/s1

InChIKey

FYXYGJIPESPIQM-XDNAFOTISA-N

Smiles

c1ccc(c(c1)Cc2ccc(cc2)O[C@H]3[C@@H]([C@H]([C@@H](CO3)O)O)O)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 36, Pg. 898, 1993.