potassium,3,4,5-trihydroxy-6-[(13-methyl-17-sulfooxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl)oxy]oxane-2-carboxylic acid

Names

[ CAS No. ]:
99156-45-3

[ Name ]:
potassium,3,4,5-trihydroxy-6-[(13-methyl-17-sulfooxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl)oxy]oxane-2-carboxylic acid

[Synonym ]:
MFCD00056533
1,3,5(10)-Estratriene-3,17|A-diol 3-glucuronide 17-sulfate
3,17beta-Dihydroxy-1,3,5(10)-estratriene 3-glucuronide 17-sulfate
3,17|A-Dihydroxy-1,3,5(10)-estratriene 3-glucuronide 17-sulfate
1,3,5(10)-Estratriene-3,17beta-diol 3-glucuronide 17-sulfate
|A-Estradiol 3-(|A-D-glucuronide) 17-sulfate dipotassium salt

Chemical & Physical Properties

[ Molecular Formula ]:
C24H30K2O11S

[ Molecular Weight ]:
604.75000

[ Exact Mass ]:
604.07800

[ PSA ]:
194.09000

[ LogP ]:
0.40520

Safety Information

[ Symbol ]:

GHS07, GHS08

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302-H312-H332-H351

[ Precautionary Statements ]:
P280

[ Personal Protective Equipment ]:
Eyeshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges

[ Hazard Codes ]:
Xn

[ Risk Phrases ]:
R40;R20/21/22

[ Safety Phrases ]:
S22;S36

[ RIDADR ]:
NONH for all modes of transport


Related Compounds

  • 1-[(tert-butoxy)carbonyl]-4-ethoxy-2,3-dihydro-1H-indole-2-carboxylic acid
  • 1-[(tert-butoxy)carbonyl]-4,6,7-trimethyl-2,3-dihydro-1H-indole-2-carboxylic acid
  • 5-Methyl-2-(5-methylthiophen-3-yl)pyrimidine-4-carboxylic acid
  • 2-(2-Methoxypropyl)-5-methylpyrimidine-4-carboxylic acid
  • Ethyl 2-(2-methoxypropyl)pyrimidine-4-carboxylate
  • Ethyl 2-(propoxymethyl)pyrimidine-4-carboxylate
  • Ethyl 2-(1,3-thiazol-5-yl)pyrimidine-4-carboxylate
  • Methyl 6-oxo-2-(thiolan-2-yl)-1,6-dihydropyrimidine-5-carboxylate
  • Methyl 2-[2-(methylsulfanyl)propan-2-yl]-6-oxo-1,6-dihydropyrimidine-5-carboxylate
  • N-(4,4-dimethylpyrrolidin-3-yl)propanamide
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