5-β-Cholanoic acid, 3-α,4-β,12-α-trihydroxy, methyl ester, TMS

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

  
• IUPAC Standard InChIKey: HUODHVYTPOSCBY-HHBLUBSASA-N Copy
• Chemical structure:
  This structure is also available as a 2d Mol file
• Stereoisomers:
  • 3α,4β,12α-trihydroxy-5β-cholanoic acid, methyl ester-trimethylsilyl-ether derivative
  • 3β,4β,12α-trihydroxy-5β-cholanoic acid acid, methyl ester-trimethylsilyl-ether derivative
• Other names: 3-α,4-β,12-α-Trihydroxy-5-β-cholanoic acid, MeTMS
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• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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