Dihydrocorynantheine
[CAS# 50439-68-4]

Identification

• Name: Dihydrocorynantheine
• Synonyms: Methyl (E)-2-[(2S,3R,12Bs)-3-Ethyl-1,2,3,4,6,7,12,12B-Octahydroindolo[3,2-H]Quinolizin-2-Yl]-3-Methoxy-Prop-2-Enoate; (E)-2-[(2S,3R,12Bs)-3-Ethyl-1,2,3,4,6,7,12,12B-Octahydroindolo[3,2-H]Quinolizin-2-Yl]-3-Methoxyprop-2-Enoic Acid Methyl Ester; (E)-2-[(2S,3R,12Bs)-3-Ethyl-1,2,3,4,6,7,12,12B-Octahydropyrido[2,1-A]$B-Carbolin-2-Yl]-3-Methoxy-Acrylic Acid Methyl Ester
• Molecular Formula: C₂₂H₂₈N₂O₃
• Molecular Weight: 368.47
• CAS Registry Number: 50439-68-4
• SMILES: [C@H]34C1=C(C2=C([NH]1)C=CC=C2)CCN3C[C@@H]([C@@H](\C(C(=O)OC)=C/OC)C4)CC
• InChI: 1S/C22H28N2O3/c1-4-14-12-24-10-9-16-15-7-5-6-8-19(15)23-21(16)20(24)11-17(14)18(13-26-2)22(25)27-3/h5-8,13-14,17,20,23H,4,9-12H2,1-3H3/b18-13+/t14-,17-,20-/m0/s1
• InChIKey: NMLUOJBSAYAYEM-XPOGPMDLSA-N

Properties

• Density: 1.209g/cm³ (Cal.)
• Boiling point: 531.709°C at 760 mmHg (Cal.)
• Flash point: 275.368°C (Cal.)

References

• (1): Merlini L. Gambirine, a new indole alkaloid from ? ? roxb., Tetrahedron Letters, 1967