(3a,4abeta,6aalpha,10abeta,10bbeta)-4,4a,6a,9,10,10a-hexahydro-4a-methyl-2-oxo-3,10b-Methano-10bH-naphtho[1,2-b]pyran-3,8,8(2H,7H)-tricarboxylicacid trimethyl ester
[CAS# 132412-55-6]

Identification

• Name: (3a,4abeta,6aalpha,10abeta,10bbeta)-4,4a,6a,9,10,10a-hexahydro-4a-methyl-2-oxo-3,10b-Methano-10bH-naphtho[1,2-b]pyran-3,8,8(2H,7H)-tricarboxylicacid trimethyl ester
• Synonyms: 4,11,11-Tris(Methoxycarbonyl)-6-Methyltricyclo(7.4.0.0)Tridec-7-Ene-4,2-Carbolactone
• Molecular Formula: C₂₁H₂₆O₈
• Molecular Weight: 406.43
• CAS Registry Number: 132412-55-6
• SMILES: [C@H]34C12OC(=O)[C@@](C1)(C[C@]2(C=C[C@@H]3CC(C(C4)C)C(OC(OC)=O)=O)C)C(OC)=O
• InChI: 1S/C21H26O8/c1-11-7-14-12(8-13(11)15(22)28-18(25)27-4)5-6-19(2)9-20(16(23)26-3)10-21(14,19)29-17(20)24/h5-6,11-14H,7-10H2,1-4H3/t11?,12-,13?,14-,19-,20-,21?/m1/s1
• InChIKey: QKWJDIKZBYYDSI-NEFVQTQASA-N

Properties

• Density: 1.322g/cm³ (Cal.)
• Boiling point: 523.173°C at 760 mmHg (Cal.)
• Flash point: 227.504°C (Cal.)