3α,6β,7β-Trihydroxy-5β-cholanoic acid, MeTMS

• Formula: C₃₄H₆₆O₅Si₃
• Molecular weight: 639.1413
• IUPAC Standard InChI: InChI=1S/C34H66O5Si3/c1-23(14-17-29(35)36-4)25-15-16-26-30-27(19-21-33(25,26)2)34(3)20-18-24(37-40(5,6)7)22-28(34)31(38-41(8,9)10)32(30)39-42(11,12)13/h23-28,30-32H,14-22H2,1-13H3/t23-,24-,25?,26?,27?,28?,30?,31+,32-,33-,34-/m0/s1 Copy

  
• IUPAC Standard InChIKey: MPBUWUAYSDIDGN-ILZJCXJKSA-N Copy
• Chemical structure:
  This structure is also available as a 2d Mol file
• Stereoisomers:
  • α-Muricholic acid, trimethyl ether-methyl ester
  • 3-α,6-α,7-β-Trihydroxy-5-β-cholic acid, methyl ester, TMS
  • 3-α,6-α,7-α-Trihydroxy-5-β-cholanoic acid, MeTMS
  • Cholanic acid, 3α,6α,7α-trihydroxy, Me-TMS
• Other names: 3α,6β,7β-Trihydroxy-5β-cholanoic acid, methyl ester-trimethylsilyl ether; 3-α,6-β,7-β-Trihydroxy-5-β-cholic acid, methyl ester, TMS; β-Muricholic acid, trimethyl ether-methyl ester; 5-β-Cholanoic acid, 3-α,6-β,7-β-trihydroxy, methyl ester, TMS
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• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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