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

  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • N-(4-Butylphenyl)-Na(2)-(diphenylmethyl)thiourea
  • 4-(azepan-1-yl)-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 5-Ethyl-3-methyl-1,3-oxazolidin-2-one
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • 4-Benzyl-1-((3-(4-fluorophenoxy)propyl)sulfonyl)piperidine
  • 2-(4-Bromophenyl)-1-(4-chlorophenyl)ethanone