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Substance Name: alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate
RN: 125161-49-1
InChIKey: AQQOALFKYJWKPJ-DBTZYBQZSA-N

Molecular Formula

  • C21-H34-O9

Molecular Weight

  • 430.4906
 
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Names and Synonyms

Synonyms

  • 1,2-O-(1-Methylethylidene)-alpha-D-glucofuranose tributanoate
  • BRN 6008582
  • Tri-O-butanyl-3,5,6 O-isopropylidene-1,2-alpha-D-glucofurannose
  • Tri-O-butanyl-3,5,6 O-isopropylidene-1,2-alpha-D-glucofurannose [French]

Systematic Name

  • alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate

Registry Numbers

CAS Registry Number

  • 125161-49-1

System Generated Number

  • 0125161491

Structure Descriptors

InChI

1S/C21H34O9/c1-6-9-14(22)25-12-13(26-15(23)10-7-2)17-18(27-16(24)11-8-3)19-20(28-17)30-21(4,5)29-19/h13,17-20H,6-12H2,1-5H3/t13-,17-,18+,19-,20-/m1/s1

InChIKey

AQQOALFKYJWKPJ-DBTZYBQZSA-N

Smiles

CCCC(=O)OC[C@H]([C@@H]1[C@@H]([C@@H]2[C@H](O1)OC(O2)(C)C)OC(=O)CCC)OC(=O)CCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 8gm/kg (8000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 24, Pg. 471, 1989.
mouse LD50 oral > 8gm/kg (8000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 24, Pg. 471, 1989.