Stigmast-4-Ene-3,6-Diol

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Catalog Number ACM113626769
Product Name Stigmast-4-Ene-3,6-Diol
CAS Number 113626-76-9
Structure Stigmast-4-Ene-3,6-Diol
IUPAC Name (3S,6R,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,6-diol
Molecular Weight 430.7
Molecular Formula C29H50O2
Canonical SMILES CCC(CCC(C)C1CCC2C1(CCC3C2CC(C4=CC(CCC34C)O)O)C)C(C)C
Inchi InChI=1S/C29H50O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h16,18-25,27,30-31H,7-15,17H2,1-6H3/t19-,20-,21+,22+,23-,24+,25+,27-,28-,29-/m1/s1
InChIKey OOUCIUZOGLWLAN-NDDUEHJASA-N
Purity 98%
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