Stigmastane-3,5,6-Triol

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Catalog Number ACM20835910
Product Name Stigmastane-3,5,6-Triol
CAS Number 20835-91-0
Structure Stigmastane-3,5,6-Triol
IUPAC Name (3S,5R,6R,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5,6-triol
Molecular Weight 448.7
Molecular Formula C29H52O3
Canonical SMILES CCC(CCC(C)C1CCC2C1(CCC3C2CC(C4(C3(CCC(C4)O)C)O)O)C)C(C)C
Inchi InChI=1S/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3/t19-,20-,21+,22+,23-,24+,25+,26-,27-,28-,29+/m1/s1
InChIKey VGSSUFQMXBFFTM-METNKUIYSA-N
Purity 98%
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