Methyl Cholate

• Synonyms:

  Methyl Cholate; Cholan-24-oic acid, 3,7,12-trihydroxy-, methyl ester, (3α,5β,7α,12α)-; Cholic acid, methyl ester (6CI,7CI,8CI); Methyl 3α,7α,12α-trihydroxy-5β-cholan-24-ate; Methyl 3α,7α,12α-trihydroxy-5β-cholan-24-oate; Methyl 3α,7α,12α-trihydroxy-5β-cholanoate; Methyl cholate; NSC 126794

• Hazard Statement:

  No Data Available

• Purity:

  >95% (HPLC)

• Smiles:

  COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C

• Molecular Formula:

  C25 H42 O5

• Molecular Weight:

  422.6

• InChI:

  InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16-,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1

• Additionnal Information:

  IUPAC name: methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate

• Shipping Conditions:

  Room Temperature

• Storage Conditions:

  +4°C

• CAS Number:

  1448-36-8