Cholestan-6-ol, acetate, (5alpha,6alpha)-

Base Information

• Chemical Name: Cholestan-6-ol, acetate, (5alpha,6alpha)-
• CAS No.: 54657-02-2
• Molecular Formula: C₂₉H₅₀O₂
• Molecular Weight: 430.715
• DSSTox Substance ID: DTXSID001300809

Synonyms:Cholestan-6-ol, acetate, (5alpha,6alpha)-;DTXSID001300809;54657-02-2

Chemical Property of Cholestan-6-ol, acetate, (5alpha,6alpha)-

Chemical Property:

• XLogP3: 10.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 430.381080833
• Heavy Atom Count: 31
• Complexity: 641

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC(C4C3(CCCC4)C)OC(=O)C)C
• Isomeric SMILES: C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H]([C@@H]4[C@@]3(CCCC4)C)OC(=O)C)C

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