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Substance Name: beta-D-Xylopyranoside, 4-((4-nitrophenyl)methyl)phenyl
RN: 99482-82-3
InChIKey: QSDSZOAFLXTJCE-XDNAFOTISA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H19-N-O7

Molecular Weight

  • 361.3481
 
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Names and Synonyms

Synonym

  • 4-((4-Nitrophenyl)methyl)phenyl-beta-D-xylopyranoside

Systematic Name

  • beta-D-Xylopyranoside, 4-((4-nitrophenyl)methyl)phenyl

Registry Numbers

CAS Registry Number

  • 99482-82-3

System Generated Number

  • 0099482823

Structure Descriptors

InChI

1S/C18H19NO7/c20-15-10-25-18(17(22)16(15)21)26-14-7-3-12(4-8-14)9-11-1-5-13(6-2-11)19(23)24/h1-8,15-18,20-22H,9-10H2/t15-,16+,17-,18+/m1/s1

InChIKey

QSDSZOAFLXTJCE-XDNAFOTISA-N

Smiles

c1cc(ccc1Cc2ccc(cc2)O[C@H]3[C@@H]([C@H]([C@@H](CO3)O)O)O)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 650mg/kg (650mg/kg)   Journal of Medicinal Chemistry. Vol. 36, Pg. 898, 1993.