Bussein
[CAS# 41060-14-4]

Identification

• Name: Bussein
• Synonyms: BUSSEIN
• Molecular Formula: C₄₃H₅₄O₁₈
• Molecular Weight: 858.88
• CAS Registry Number: 41060-14-4
• SMILES: CC(C)C(\O)=C2\C(=O)O[C@@H](c1ccoc1)[C@]3(C)C(OC(C)=O)[C@@H](OC(C)=O)[C@@]86OC4(C)O[C@]8(C23)[C@H](OC(C)=O)[C@@]7(O)C(OC(=O)C(C)C)C5(C)CC7(O4)[C@@]6(C)[C@H]5CC(=O)OC
• InChI: 1S/C43H54O18/c1-18(2)27(48)26-28-37(9,29(57-33(26)50)23-13-14-53-16-23)30(54-20(5)44)31(55-21(6)45)43-38(10)24(15-25(47)52-12)36(8)17-40(38)41(51,34(36)58-32(49)19(3)4)35(56-22(7)46)42(28,43)60-39(11,59-40)61-43/h13-14,16,18-19,24,28-31,34-35,48,51H,15,17H2,1-12H3/b27-26-/t24-,28?,29-,30?,31+,34?,35+,36?,37+,38+,39?,40?,41-,42+,43-/m0/s1
• InChIKey: KVAGRMDUXLYLAZ-ZGZXWHTRSA-N

Properties

• Density: 1.426g/cm³ (Cal.)
• Boiling point: 847.178°C at 760 mmHg (Cal.)
• Flash point: 466.156°C (Cal.)