Shionone

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Catalog Number ACM10376484
Product Name Shionone
CAS Number 10376-48-4
Structure Shionone
IUPAC Name (1R,4bS,6aS,8R,10aR,12aS)-1,4b,6a,8,10a,12a-hexamethyl-8-(4-methylpent-3-enyl)-1,3,4,4a,5,6,7,9,10,10b,11,12-dodecahydrochrysen-2-one
Molecular Weight 426.72
Molecular Formula C30H50O
Canonical SMILES CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC(C4)(C)CCC=C(C)C)C)C)C)C
Inchi InChI=1S/C30H50O/c1-21(2)10-9-14-26(4)16-19-30(8)25-13-15-28(6)22(3)23(31)11-12-24(28)29(25,7)18-17-27(30,5)20-26/h10,22,24-25H,9,11-20H2,1-8H3/t22-,24?,25?,26+,27-,28+,29-,30+/m0/s1
InChIKey HXPXUNQUXCHJLL-PYOYDRRISA-N
Purity 98%
Appearance Powder

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