Milbemectin A4
[CAS# 51596-11-3]

Identification

• Name: Milbemectin A4
• Synonyms: Milbemycin A4; Milbemycin B, 5-O-Demethyl-28-Deoxy-6,28-Epoxy-25-Ethyl-, (6R,25R)-
• Molecular Formula: C₃₂H₄₆O₇
• Molecular Weight: 542.71
• CAS Registry Number: 51596-11-3
• SMILES: [C@]\13(O)[C@@H]4OCC1=C\C=C\C(CC(=C/C[C@H]5O[C@]2(OC(C(CC2)C)CC)C[C@@H](OC(=O)[C@@H]3C=C([C@H]4O)C)C5)/C)C
• InChI: 1S/C32H46O7/c1-6-27-21(4)12-13-31(39-27)17-25-16-24(38-31)11-10-20(3)14-19(2)8-7-9-23-18-36-29-28(33)22(5)15-26(30(34)37-25)32(23,29)35/h7-10,15,19,21,24-29,33,35H,6,11-14,16-18H2,1-5H3/b8-7+,20-10+,23-9+/t19?,21?,24-,25+,26+,27?,28-,29-,31-,32-/m1/s1
• InChIKey: VOZIAWLUULBIPN-DFYAAVTESA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 732.9±60.0°C at 760 mmHg (Cal.)
• Flash point: 233.3±26.4°C (Cal.)