Products 35988-42-2

CAS 35988-42-2 is the registry number for Carboxyatractyloside (potassium salt). Offered by: GLPBio. Available pack sizes: 1mg, 5mg, 500μg.

Carboxyatractyloside (potassium salt)
GLPBio
  • size: 1mg, 5mg, 500μg
  • Variants: 3
from 700.01
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Structural formula: {0} (CAS {1})

15-hydroxy-7-[6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-4,5-disulfooxyoxan-2-yl]oxy-9-methyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5,5-dicarboxylic acid (CAS 35988-42-2) is a chemical compound with the molecular formula C31H46O18S2 and a molecular weight of 770.8 g/mol. IUPAC name: 15-hydroxy-7-[6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-4,5-disulfooxyoxan-2-yl]oxy-9-methyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5,5-dicarboxylic acid. InChIKey: AQFATIOBERWBDY-UHFFFAOYSA-N.

Identity
Molecular formulaC31H46O18S2
Molecular weight770.8 g/mol
IUPAC name15-hydroxy-7-[6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-4,5-disulfooxyoxan-2-yl]oxy-9-methyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5,5-dicarboxylic acid
InChIKeyAQFATIOBERWBDY-UHFFFAOYSA-N
SMILESCC(C)CC(=O)OC1C(C(C(OC1OC2CC3(C4CCC5CC4(CCC3C(C2)(C(=O)O)C(=O)O)C(C5=C)O)C)CO)OS(=O)(=O)O)OS(=O)(=O)O

Computed by PubChem (NCBI)

Synonyms: Carboxyatractylate, Carboxyatractyloside Potassium Salt, C-ATR; CAT; Carboxyatractyloside dipotassium salt, Carboxyatractyloside tripotassium salt
Related forms of this compound
15-hydroxy-7-[6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-4,5-disulfooxyoxan-2-yl]oxy-9-methyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5,5-dicarboxylic acid C31H46O18S2
(1R,4S,7S,9S,10S,13R,15S)-15-hydroxy-7-[(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-4,5-disulfooxyoxan-2-yl]oxy-9-methyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5,5-dicarboxylic acid C31H46O18S2