Stigmast-7-enol
(3S,9R,10S,13R,14R,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: Stigmast-7-enol|Stigmast-7-en-3-ol|22,23-Dihydrospinasterol|delta(7)-Stigmastenol|Stigmast-7-en-3beta-ol|DELTA7-SITOSTEROL|Stigmast-7-en-3-ol, (3b)-|Stigmast-7-en-3-ol, (3beta)-|(1R,3aR,7S,9aS,9bR,11aR)-1-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol|(3S,9R,10S,13R,14R,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
| Molecular Formula | C29H50O |
|---|---|
| Molecular Weight | 414.38617 g/mol |
| LogP | 8.0248 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.38617 |
| Monoisotopic Mass | 414.38617 |
| Heavy Atoms | 30 |
| Complexity | 634.27484 |
Chemical Identifiers
| CAS Number | 6869-99-4 |
|---|---|
| SMILES | CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CCC4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C |
Product Overview
Stigmast-7-enol (CAS 6869-99-4), with molecular formula C29H50O and molecular weight 414.38617 g/mol. IUPAC: (3S,9R,10S,13R,14R,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
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