(3beta)-Cholest-5-en-3-yl (11Z)-11-icosenoate
[CAS# 70832-37-0]

Identification

• Name: (3beta)-Cholest-5-en-3-yl (11Z)-11-icosenoate
• Synonyms: CHOLESTERYL CIS-11-EICOSENOATE
• Molecular Formula: C₄₇H₈₂O₂
• Molecular Weight: 679.15
• CAS Registry Number: 70832-37-0
• SMILES: O=C(O[C@@H]4C/C3=C/C[C@@H]1[C@H](CC[C@]2([C@H]1CC[C@@H]2[C@H](C)CCCC(C)C)C)[C@@]3(C)CC4)CCCCCCCCC\C=C/CCCCCCCC
• InChI: 1S/C47H82O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-45(48)49-40-32-34-46(5)39(36-40)28-29-41-43-31-30-42(38(4)26-24-25-37(2)3)47(43,6)35-33-44(41)46/h14-15,28,37-38,40-44H,7-13,16-27,29-36H2,1-6H3/b15-14-/t38-,40+,41+,42-,43+,44+,46+,47-/m1/s1
• InChIKey: OWTYWMJVQZQWFH-UQPFUGTCSA-N

Properties

• Density: 0.954g/cm³ (Cal.)
• Boiling point: 690.758°C at 760 mmHg (Cal.)
• Flash point: 372.456°C (Cal.)