(3a,5b,7a,12a)- 3,7,12,24-tetrahydroxy-cholestan-26-oic acid

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Names

[ CAS No. ]:
1061-64-9

[ Name ]:
(3a,5b,7a,12a)- 3,7,12,24-tetrahydroxy-cholestan-26-oic acid

[Synonym ]:
TTHCA
3alpha,7alpha,12alpha,24xi-tetrahydroxy-5beta-cholestan-26-oic acid
3,7,12,24-Tetrahydroxycholestanoic acid
3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestanoic acid
3alpha,7alpha,12alpha,24-Tetrahydroxy-5beta-cholestan-26-oic acid
Varanic acid

Chemical & Physical Properties

[ Density]:
1.188g/cm3

[ Boiling Point ]:
638.4ºC at 760mmHg

[ Molecular Formula ]:
C27H46O6

[ Molecular Weight ]:
466.65100

[ Flash Point ]:
353.9ºC

[ Exact Mass ]:
466.32900

[ PSA ]:
118.22000

[ LogP ]:
3.44570

[ Vapour Pressure ]:
5.47E-19mmHg at 25°C

[ Index of Refraction ]:
1.558

Synthetic Route

Precursor & DownStream

Precursor

  • cholic acid
  • (3α,5β,7α,12α)-3,7,12-tris(formyloxy)cholan-24-oyl chloride
  • 3α,7α,12α-tris[(tetrahydropyran-2-yl)oxy]-5β-cholan-24-ol
  • tris-tetrahydropyranyl ether of cholic acid

DownStream

  • Dehydrocholic acid