(1-alpha,6-beta,14-alpha,16-beta)-1,16-dimethoxy-20-ethyl-4-methyl-7,8-(methylenebis(oxy))-Aconitane-6,10,14-triol 6,14-diacetate
[CAS# 75659-26-6]

Identification

• Name: (1-alpha,6-beta,14-alpha,16-beta)-1,16-dimethoxy-20-ethyl-4-methyl-7,8-(methylenebis(oxy))-Aconitane-6,10,14-triol 6,14-diacetate
• Synonyms: Nsc624742; Aconitane-6,10,14-Triol, 1,16-Dimethoxy-20-Ethyl-4-Methyl-7,8-(Methylenebis(Oxy))-, 6,14-Diacetate, (1-Alpha,6-Beta,14-Alpha,16-Beta)-; Dictyocarpine 14-Acetate
• Molecular Formula: C₂₈H₄₁NO₉
• Molecular Weight: 535.63
• CAS Registry Number: 75659-26-6
• SMILES: C(N7C2C13C(CCC(C1C(C26C4(C5C3(CC(C(C4)OC)C5OC(=O)C)O)OCO6)OC(=O)C)(C)C7)OC)C
• InChI: 1S/C28H41NO9/c1-7-29-12-24(4)9-8-18(34-6)27-21(24)22(38-15(3)31)28(23(27)29)26(35-13-36-28)11-17(33-5)16-10-25(27,32)20(26)19(16)37-14(2)30/h16-23,32H,7-13H2,1-6H3
• InChIKey: YRFHHBLWWCMRSY-UHFFFAOYSA-N

Properties

• Density: 1.354g/cm³ (Cal.)
• Boiling point: 614.679°C at 760 mmHg (Cal.)
• Flash point: 325.546°C (Cal.)