Cholesterol, H-3
(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2-ditritio-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: cholesterol|Cholesterol, H-3|3h-cholesterol|H3-CHOLESTEROL|CHOLESTEROL-1,2-3H2|Cholest-5-en-1,2-t2-3-ol, (3beta)-|(1,2-~3~H_2_)Cholest-5-en-3-ol|(1,2-~3~H_2_)Cholest-5-en-3beta-ol|CHOLEST-5-EN-1,2-T2-3-OL, (3.BETA.)-|(3R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2-ditritio-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
| Molecular Formula | C27H46O |
|---|---|
| Molecular Weight | 390.3713 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.3713 |
| Monoisotopic Mass | 390.3713 |
| Heavy Atoms | 28 |
| Complexity | 591.0 |
Chemical Identifiers
| CAS Number | 17822-79-6 |
|---|---|
| SMILES | [3H]C1[C@@H](CC2=CC[C@H]3[C@@H]4CC[C@@H]([C@]4(CC[C@@H]3[C@]2(C1[3H])C)C)[C@H](C)CCCC(C)C)O |
| InChIKey | HVYWMOMLDIMFJA-OZXVBKCJSA-N |
Product Overview
Cholesterol, H-3 (CAS 17822-79-6), with molecular formula C27H46O and molecular weight 390.3713 g/mol. IUPAC: (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2-ditritio-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
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