Hirsuteine
[CAS# 18904-54-6]

Identification

• Name: Hirsuteine
• Synonyms: Methyl (E)-2-[(2S,3R,12Bs)-3-Vinyl-1,2,3,4,6,7,12,12B-Octahydroindolo[3,2-H]Quinolizin-2-Yl]-3-Methoxy-Prop-2-Enoate Hydrochloride; (E)-2-[(2S,3R,12Bs)-3-Vinyl-1,2,3,4,6,7,12,12B-Octahydroindolo[3,2-H]Quinolizin-2-Yl]-3-Methoxyprop-2-Enoic Acid Methyl Ester Hydrochloride; (E)-2-[(2S,3R,12Bs)-3-Vinyl-1,2,3,4,6,7,12,12B-Octahydropyrido[2,1-A]$B-Carbolin-2-Yl]-3-Methoxy-Acrylic Acid Methyl Ester Hydrochloride
• Molecular Formula: C₂₂H₂₇ClN₂O₃
• Molecular Weight: 402.92
• CAS Registry Number: 18904-54-6
• SMILES: [C@H]12N(C[C@@H]([C@H](C1)\C(C(OC)=O)=C/OC)C=C)CCC3=C2[NH]C4=C3C=CC=C4.[H+].[Cl-]
• InChI: 1S/C22H26N2O3.ClH/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;/h4-8,13-14,17,20,23H,1,9-12H2,2-3H3;1H/b18-13+;/t14-,17-,20-;/m0./s1
• InChIKey: LHDAPOGMZVLZPY-PTRHOHCYSA-N

Properties

• Boiling point: 533.2°C at 760 mmHg (Cal.)
• Flash point: 276.3°C (Cal.)