[(1R,4R,4aR,5S,7R,8S,8aR)-8-[(3aR,6aS)-2,3,3a,4,5,6a-Hexahydrofuro[5,4-b]Furan-2-Yl]-5-Acetyloxy-4a-(Acetyloxymethyl)-3-Hydroxy-7,8-Dimethylspiro[2,3,5,6,7,8a-Hexahydro-1H-Naphthalene-4,2'-Oxirane]-1-Yl] (2S)-2-Methylbutanoate
[CAS# 72160-84-0]

Identification

• Name: [(1R,4R,4aR,5S,7R,8S,8aR)-8-[(3aR,6aS)-2,3,3a,4,5,6a-Hexahydrofuro[5,4-b]Furan-2-Yl]-5-Acetyloxy-4a-(Acetyloxymethyl)-3-Hydroxy-7,8-Dimethylspiro[2,3,5,6,7,8a-Hexahydro-1H-Naphthalene-4,2'-Oxirane]-1-Yl] (2S)-2-Methylbutanoate
• Synonyms: [(1R,4R,4Ar,5S,7R,8S,8Ar)-8-[(3Ar,6As)-2,3,3A,4,5,6A-Hexahydrofuro[5,4-B]Furan-2-Yl]-5-Acetoxy-4A-(Acetoxymethyl)-3-Hydroxy-7,8-Dimethyl-Spiro[Decalin-4,2'-Oxirane]-1-Yl] (2S)-2-Methylbutanoate; (2S)-2-Methylbutanoic Acid [(1R,4R,4Ar,5S,7R,8S,8Ar)-8-[(3Ar,6As)-2,3,3A,4,5,6A-Hexahydrofuro[5,4-B]Furan-2-Yl]-5-Acetoxy-4A-(Acetoxymethyl)-3-Hydroxy-7,8-Dimethyl-1-Spiro[Decalin-4,2'-Oxirane]Yl] Ester; (2S)-2-Methylbutyric Acid [(1R,4R,4Ar,5S,7R,8S,8Ar)-8-[(3Ar,6As)-2,3,3A,4,5,6A-Hexahydrofuro[5,4-B]Furan-2-Yl]-5-Acetoxy-4A-(Acetoxymethyl)-3-Hydroxy-7,8-Dimethyl-Spiro[Decalin-4,2'-Oxirane]-1-Yl] Ester
• Molecular Formula: C₂₉H₄₄O₁₀
• Molecular Weight: 552.66
• CAS Registry Number: 72160-84-0
• SMILES: [C@@H](C(=O)O[C@@H]1CC([C@]5([C@]2([C@H]1[C@@]([C@@H](C[C@@H]2OC(=O)C)C)(C)C3O[C@H]4[C@@H](C3)CCO4)COC(=O)C)OC5)O)(CC)C
• InChI: 1S/C29H44O10/c1-7-15(2)25(33)38-20-12-21(32)29(14-36-29)28(13-35-17(4)30)23(37-18(5)31)10-16(3)27(6,24(20)28)22-11-19-8-9-34-26(19)39-22/h15-16,19-24,26,32H,7-14H2,1-6H3/t15-,16+,19+,20+,21?,22?,23-,24+,26-,27+,28+,29+/m0/s1
• InChIKey: YKWBDFBNTYGFFZ-JBXMTNKTSA-N

Properties

• Density: 1.257g/cm³ (Cal.)
• Boiling point: 612.569°C at 760 mmHg (Cal.)
• Flash point: 190.75°C (Cal.)