Desmethyl Cerivastatin-O-beta-D-glucuronide
[CAS# 212616-56-3]

Identification

• Name: Desmethyl Cerivastatin-O-beta-D-glucuronide
• Synonyms: Desmethyl Cerivastatin-O-¦Â-D-glucuronide; Desmethyl Cerivastatin-O-β-D-glucuronide
• Molecular Formula: C₃₁H₄₀FNO₁₁
• Molecular Weight: 621.65
• CAS Registry Number: 212616-56-3
• SMILES: CC(C)c1c(c(c(c(n1)C(C)C)/C=C/[C@H](C[C@H](CC(=O)O)O)O)c2ccc(cc2)F)CO[C@H]3[C@H]([C@H]([C@@H](C(O3)C(=O)O)O)O)O
• InChI: 1S/C31H40FNO11/c1-14(2)24-20(10-9-18(34)11-19(35)12-22(36)37)23(16-5-7-17(32)8-6-16)21(25(33-24)15(3)4)13-43-31-28(40)26(38)27(39)29(44-31)30(41)42/h5-10,14-15,18-19,26-29,31,34-35,38-40H,11-13H2,1-4H3,(H,36,37)(H,41,42)/b10-9+/t18-,19-,26+,27+,28+,29?,31-/m1/s1
• InChIKey: AKMUKCNIVAOAKJ-QXQRHCPRSA-N

Properties

• Density: 1.423g/cm³ (Cal.)
• Boiling point: 876.391°C at 760 mmHg (Cal.)
• Flash point: 483.824°C (Cal.)
• Refractive index: 1.623 (Cal.)