(3alpha,5R,6beta)-6-Methoxy-3,5-cyclocholestane
(1S,2R,5R,7R,8R,10S,11S,14R,15R)-8-methoxy-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]pentacyclo[8.7.0.02,7.05,7.011,15]heptadecane
Also Known As: i-Cholesterol methyl ether|i-Cholesteryl methyl ether|6beta-Methoxy-i-cholesterol|6-Methoxy-3,5-cyclocholestane|3,5-Cyclocholestane, 6-methoxy-|KST-1A3538|6.BETA.-METHOXY-I-CHOLESTEROL|HY-W127440|6-beta-Methoxy-3-alpha,5-cyclo-5-alpha-cholestane|(3|A,5|A,6|A)-6-methoxy-3,5-cyclocholestane|6beta-Methoxy-3alpha,5-cyclo-5alpha-cholestane|3-alpha,5-Cyclo-5-alpha-cholestane, 6-beta-methoxy-|3alpha,5-Cyclo-5alpha-cholestan-6beta-ol methyl ether|3,5-Cyclocholestane,6-methoxy-, (3a,5R,6b)-|5-cyclo-5-alpha-cholestane,6-beta-methoxy-3-alph|(3alpha,5R,6beta)-6-Methoxy-3,5-cyclocholestane|3,5-Cyclocholestane, 6-methoxy-, (3beta,5alpha,6beta)-|3,5-Cyclocholestane, 6-methoxy-, (3-beta,5-alpha,6-beta)-|(1S,2R,5R,7R,8R,10S,11S,14R,15R)-8-methoxy-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]pentacyclo[8.7.0.02,7.05,7.011,15]heptadecane|(1AR,3aR,3bS,5aR,6R,8aS,8bS,10R,10aR)-10-methoxy-3a,5a-dimethyl-6-((R)-6-methylheptan-2-yl)hexadecahydrocyclopenta[a]cyclopropa[2,3]cyclopenta[1,2-f]naphthalene|CC12CCC3CC13C(OC)CC4C2CCC5(C)C(CCC45)C(C)CCCC(C)C|3,5-Cyclocholestane, 6-methoxy-, (3.beta.,5.alpha.,6.beta.)-
| Molecular Formula | C28H48O |
|---|---|
| Molecular Weight | 400.3705 g/mol |
| LogP | 7.73 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.3705 |
| Heavy Atoms | 29 |
| Complexity | 625.8 |
Chemical Identifiers
| CAS Number | 2867-93-8 |
|---|---|
| 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@@]45[C@@]3(CC[C@@H]4C5)C)OC)C |
Product Overview
(3alpha,5R,6beta)-6-Methoxy-3,5-cyclocholestane (CAS 2867-93-8), with molecular formula C28H48O and molecular weight 400.3705 g/mol. IUPAC: (1S,2R,5R,7R,8R,10S,11S,14R,15R)-8-methoxy-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]pentacyclo[8.7.0.02,7.05,7.011,15]heptadecane.
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