(1alpha,14alpha(E),16beta)-20-Ethyl-16-Methoxy-4-(Methoxymethyl)-Aconitane-1,8,14-Triol 14-(3-(3,4-Dimethoxyphenyl)-2-Propenoate)
[CAS# 103956-41-8]

Identification

• Name: (1alpha,14alpha(E),16beta)-20-Ethyl-16-Methoxy-4-(Methoxymethyl)-Aconitane-1,8,14-Triol 14-(3-(3,4-Dimethoxyphenyl)-2-Propenoate)
• Molecular Formula: C₃₄H₄₇NO₈
• Molecular Weight: 597.75
• CAS Registry Number: 103956-41-8
• SMILES: C7=C(/C=C/C(OC2C1C3C46C5CC(C1(CC(C2C3)OC)O)C4N(CC)CC5(COC)CCC6O)=O)C=C(C(=C7)OC)OC
• InChI: 1S/C34H47NO8/c1-6-35-17-32(18-39-2)12-11-27(36)34-21-14-20-25(42-5)16-33(38,22(31(34)35)15-26(32)34)29(21)30(20)43-28(37)10-8-19-7-9-23(40-3)24(13-19)41-4/h7-10,13,20-22,25-27,29-31,36,38H,6,11-12,14-18H2,1-5H3/b10-8+
• InChIKey: OSGULNOCFPGGSK-CSKARUKUSA-N

Properties

• Density: 1.302g/cm³ (Cal.)
• Boiling point: 714.817°C at 760 mmHg (Cal.)
• Flash point: 386.107°C (Cal.)