[(1R,2S,3R,4aR,5R,8S,8aR)-5-[(2S,3aS,6aS)-2,3,3a,6a-Tetrahydrofuro[5,4-b]Furan-2-Yl]-8-Acetyloxy-8a-(Acetyloxymethyl)-3-Hydroxy-5,6-Dimethylspiro[3,4,4a,8-Tetrahydro-2H-Naphthalene-1,2'-Oxirane]-2-Yl] (2R)-2-Acetyloxy-2-Methylbutanoate
[CAS# 35481-70-0]

Identification

• Name: [(1R,2S,3R,4aR,5R,8S,8aR)-5-[(2S,3aS,6aS)-2,3,3a,6a-Tetrahydrofuro[5,4-b]Furan-2-Yl]-8-Acetyloxy-8a-(Acetyloxymethyl)-3-Hydroxy-5,6-Dimethylspiro[3,4,4a,8-Tetrahydro-2H-Naphthalene-1,2'-Oxirane]-2-Yl] (2R)-2-Acetyloxy-2-Methylbutanoate
• Synonyms: [(1R,2S,3R,4Ar,5R,8S,8Ar)-5-[(2S,3As,6As)-2,3,3A,6A-Tetrahydrofuro[5,4-B]Furan-2-Yl]-8-Acetoxy-8A-(Acetoxymethyl)-3-Hydroxy-5,6-Dimethyl-Spiro[3,4,4A,8-Tetrahydro-2H-Naphthalene-1,2'-Oxirane]-2-Yl] (2R)-2-Acetoxy-2-Methyl-Butanoate; (2R)-2-Acetoxy-2-Methylbutanoic Acid [(1R,2S,3R,4Ar,5R,8S,8Ar)-5-[(2S,3As,6As)-2,3,3A,6A-Tetrahydrofuro[5,4-B]Furan-2-Yl]-8-Acetoxy-8A-(Acetoxymethyl)-3-Hydroxy-5,6-Dimethyl-2-Spiro[3,4,4A,8-Tetrahydro-2H-Naphthalene-1,2'-Oxirane]Yl] Ester; (2R)-2-Acetoxy-2-Methyl-Butyric Acid [(1R,2S,3R,4Ar,5R,8S,8Ar)-5-[(2S,3As,6As)-2,3,3A,6A-Tetrahydrofuro[5,4-B]Furan-2-Yl]-8-Acetoxy-8A-(Acetoxymethyl)-3-Hydroxy-5,6-Dimethyl-Spiro[3,4,4A,8-Tetrahydro-2H-Naphthalene-1,2'-Oxirane]-2-Yl] Ester
• Molecular Formula: C₃₁H₄₂O₁₂
• Molecular Weight: 606.67
• CAS Registry Number: 35481-70-0
• SMILES: [C@]45([C@]3([C@@H]([C@]([C@H]2O[C@@H]1OC=C[C@@H]1C2)(C)C(=C[C@@H]3OC(=O)C)C)C[C@H]([C@@H]4OC([C@](OC(=O)C)(CC)C)=O)O)COC(=O)C)OC5
• InChI: 1S/C31H42O12/c1-8-28(6,43-19(5)34)27(36)42-25-21(35)13-22-29(7,23-12-20-9-10-37-26(20)41-23)16(2)11-24(40-18(4)33)30(22,14-38-17(3)32)31(25)15-39-31/h9-11,20-26,35H,8,12-15H2,1-7H3/t20-,21-,22-,23+,24+,25+,26+,28-,29+,30+,31-/m1/s1
• InChIKey: NXKWGKNTUFLKGN-NLDKIVAHSA-N

Properties

• Density: 1.319g/cm³ (Cal.)
• Boiling point: 675.088°C at 760 mmHg (Cal.)
• Flash point: 209.932°C (Cal.)