(1R,3S,5E)-5-[(2E)-2-[(3aS,7aR)-1-[(E)-8-Hydroxy-8-Methylnon-3-En-2-Yl]-7alpha-Methyl-2,3,3a,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylidenecyclohexane-1,3-Diol
[CAS# 154356-84-0]

Identification

• Name: (1R,3S,5E)-5-[(2E)-2-[(3aS,7aR)-1-[(E)-8-Hydroxy-8-Methylnon-3-En-2-Yl]-7alpha-Methyl-2,3,3a,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylidenecyclohexane-1,3-Diol
• Synonyms: (1R,3S,5E)-5-[(2E)-2-[(3As,7Ar)-1-[(E)-7-Hydroxy-1,7-Dimethyl-Oct-2-Enyl]-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylene-Cyclohexane-1,3-Diol; (1R,3S,5E)-5-[(2E)-2-[(3As,7Ar)-1-[(E)-7-Hydroxy-1,7-Dimethyloct-2-Enyl]-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylenecyclohexane-1,3-Diol; (1R,3S,5E)-5-[(2E)-2-[(3As,7Ar)-1-[(E)-8-Hydroxy-8-Methyl-Non-3-En-2-Yl]-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylidene-Cyclohexane-1,3-Diol
• Molecular Formula: C₂₉H₄₆O₃
• Molecular Weight: 442.68
• CAS Registry Number: 154356-84-0
• SMILES: [C@]13([C@H](\C(CCC1)=C\C=C/2C([C@@H](O)C[C@H](O)C2)=C)CCC3C(\C=C\CCCC(O)(C)C)C)C
• InChI: 1S/C29H46O3/c1-20(10-7-6-8-16-28(3,4)32)25-14-15-26-22(11-9-17-29(25,26)5)12-13-23-18-24(30)19-27(31)21(23)2/h7,10,12-13,20,24-27,30-32H,2,6,8-9,11,14-19H2,1,3-5H3/b10-7+,22-12+,23-13+/t20?,24-,25?,26+,27+,29-/m1/s1
• InChIKey: ZSRZLHUUFCGCDW-AKLISYRYSA-N

Properties

• Density: 1.06g/cm³ (Cal.)
• Boiling point: 593.74°C at 760 mmHg (Cal.)
• Flash point: 247.247°C (Cal.)