Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Methanone, (4-chlorophenyl)(4-(beta-D-galactopyranosyloxy)phenyl)-, hemihydrate
RN: 83357-01-1
InChIKey: FHGFQMNKMSEOMB-QFACEVIFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H19-Cl-O7.1/2H2-O

Molecular Weight

  • 394.8051
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • (4-Chlorophenyl)(4-(beta-D-galactopyranosyloxy)phenyl)methanone hemihydrate

Systematic Name

  • Methanone, (4-chlorophenyl)(4-(beta-D-galactopyranosyloxy)phenyl)-, hemihydrate

Registry Numbers

CAS Registry Number

  • 83357-01-1

System Generated Number

  • 0083357011

Molecular Formulas

Molecular Formula

  • C19-H19-Cl-O7.1/2H2-O

Molecular Formula Fragments

  • C19-H19-Cl-O7
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C19H19ClO7/c20-12-5-1-10(2-6-12)15(22)11-3-7-13(8-4-11)26-19-18(25)17(24)16(23)14(9-21)27-19/h1-8,14,16-19,21,23-25H,9H2/t14-,16+,17+,18-,19-/m1/s1

InChIKey

FHGFQMNKMSEOMB-QFACEVIFSA-N

Smiles

c1cc(ccc1C(=O)c2ccc(cc2)Cl)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O

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.