(3E,3aR,8bS)-3-[[(2S)-4-Methyl-5-Oxo-2H-Furan-2-Yl]Oxymethylidene]-4,8b-Dihydro-3aH-Indeno[2,1-d]Furan-2-One
[CAS# 76974-79-3]

Identification

• Name: (3E,3aR,8bS)-3-[[(2S)-4-Methyl-5-Oxo-2H-Furan-2-Yl]Oxymethylidene]-4,8b-Dihydro-3aH-Indeno[2,1-d]Furan-2-One
• Synonyms: (3E,3Ar,8Bs)-3-[[(2S)-4-Methyl-5-Oxo-2H-Furan-2-Yl]Oxymethylene]-4,8B-Dihydro-3Ah-Indeno[2,1-D]Furan-2-One; (3E,3Ar,8Bs)-3-[[(2S)-5-Keto-4-Methyl-2H-Furan-2-Yl]Oxymethylene]-4,8B-Dihydro-3Ah-Indeno[2,1-D]Furan-2-One; 2H-Indeno(1,2-B)Furan-2-One, 3-((((2R)-2,5-Dihydro-4-Methyl-5-Oxo-2-Furanyl)Oxy)Methylene)-3,3A,4,8B-Tetrahydro-, (3E,3Ar,8Bs)-Rel-
• Molecular Formula: C₁₇H₁₄O₅
• Molecular Weight: 298.29
• CAS Registry Number: 76974-79-3
• SMILES: [C@H]12OC(C(/[C@H]1CC3=C2C=CC=C3)=C/O[C@H]4OC(C(=C4)C)=O)=O
• InChI: 1S/C17H14O5/c1-9-6-14(21-16(9)18)20-8-13-12-7-10-4-2-3-5-11(10)15(12)22-17(13)19/h2-6,8,12,14-15H,7H2,1H3/b13-8+/t12-,14+,15-/m1/s1
• InChIKey: XHSDUVBUZOUAOQ-IMBONUEFSA-N

Properties

• Density: 1.392g/cm³ (Cal.)
• Boiling point: 567.662°C at 760 mmHg (Cal.)
• Flash point: 254.871°C (Cal.)

References

• (1): Tsuchiya et al.. A small molecule screen identifies new functions for the plant hormone strigolactone, Nature Chemical Biology, 2010