Geissoschizine
[CAS# 439-66-7]

Identification

• Name: Geissoschizine
• Synonyms: Methyl 2-[(2R,3E,12Bs)-3-Ethylidene-2,4,6,7,12,12B-Hexahydro-1H-Indolo[3,2-H]Quinolizin-2-Yl]-3-Oxo-Propanoate; 2-[(2R,3E,12Bs)-3-Ethylidene-2,4,6,7,12,12B-Hexahydro-1H-Indolo[3,2-H]Quinolizin-2-Yl]-3-Oxopropanoic Acid Methyl Ester; 2-[(2R,3E,12Bs)-3-Ethylidene-2,4,6,7,12,12B-Hexahydro-1H-Pyrido[2,1-A]$B-Carbolin-2-Yl]-3-Keto-Propionic Acid Methyl Ester
• Molecular Formula: C₂₁H₂₄N₂O₃
• Molecular Weight: 352.43
• CAS Registry Number: 439-66-7
• SMILES: [C@H]34C2=C(C1=CC=CC=C1[NH]2)CCN3CC(/[C@H](C4)C(C(=O)OC)C=O)=C/C
• InChI: 1S/C21H24N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h3-7,12,16-17,19,22H,8-11H2,1-2H3/b13-3-/t16-,17?,19-/m0/s1
• InChIKey: AUOFTPXWUVYOOQ-VJBMQPMPSA-N

Properties

• Density: 1.261g/cm³ (Cal.)
• Boiling point: 528.33°C at 760 mmHg (Cal.)
• Flash point: 273.324°C (Cal.)