(1S,3S)-5-(4,5-Dimethoxy-2-Methylnaphthalen-1-Yl)-8-Methoxy-1,3-Dimethyl-1,2,3,4-Tetrahydroisoquinolin-6-Ol
[CAS# 32221-59-3]

Identification

• Name: (1S,3S)-5-(4,5-Dimethoxy-2-Methylnaphthalen-1-Yl)-8-Methoxy-1,3-Dimethyl-1,2,3,4-Tetrahydroisoquinolin-6-Ol
• Synonyms: (1S,3S)-5-(4,5-Dimethoxy-2-Methyl-1-Naphthyl)-8-Methoxy-1,3-Dimethyl-1,2,3,4-Tetrahydroisoquinolin-6-Ol; (1S,3S)-5-(4,5-Dimethoxy-2-Methyl-Naphthalen-1-Yl)-8-Methoxy-1,3-Dimethyl-1,2,3,4-Tetrahydroisoquinolin-6-Ol; (-)-Ancistrocladine
• Molecular Formula: C₂₅H₂₉NO₄
• Molecular Weight: 407.51
• CAS Registry Number: 32221-59-3 (56688-90-5)
• SMILES: [C@@H]4(C1=C(C(=C(C=C1OC)O)C2=C(C=C(OC)C3=C2C=CC=C3OC)C)C[C@@H](N4)C)C
• InChI: 1S/C25H29NO4/c1-13-10-20(29-5)25-16(8-7-9-19(25)28-4)22(13)24-17-11-14(2)26-15(3)23(17)21(30-6)12-18(24)27/h7-10,12,14-15,26-27H,11H2,1-6H3/t14-,15-/m0/s1
• InChIKey: XUFOYASAFNKRRE-GJZGRUSLSA-N

Properties

• Density: 1.137g/cm³ (Cal.)
• Boiling point: 565.308°C at 760 mmHg (Cal.)
• Flash point: 295.688°C (Cal.)