12239-34-8 Purity
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Specification
The PubChem CID for stigmastanol is 241572.
The molecular formula of stigmastanol is C29H52O.
The molecular weight of stigmastanol is 416.7 g/mol.
The synonyms for stigmastanol include sitostanol, Fucostanol, and Spinastanol.
The IUPAC name of stigmastanol is (3S,5S,8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol.
The InChI of stigmastanol is InChI=1S/C29H52O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h19-27,30H,7-18H2,1-6H3/t20-,21-,22+,23+,24-,25-,26+,27+,28+,29-/m1/s1.
The canonical SMILES of stigmastanol is CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C.
The CAS number for stigmastanol is 83-45-4.
The European Community (EC) number for stigmastanol is 201-479-0.
The Wikipedia page for stigmastanol can be found at Stigmastanol.