5,6,6a,7-Tetrahydro-1,2,10-trimethoxy-6-methyl-4H-Dibenzo[de,g]quinolin-11-ol
[CAS# 36284-37-4]

Identification

• Name: 5,6,6a,7-Tetrahydro-1,2,10-trimethoxy-6-methyl-4H-Dibenzo[de,g]quinolin-11-ol
• Synonyms: Luteanine (Aporphine); Nsc32979; 4H-Dibenzo(De,G)Quinolin-11-Ol, 5,6,6A,7-Tetrahydro-1,2,10-Trimethoxy-6-Methyl-, (+-)
• Molecular Formula: C₂₀H₂₃NO₄
• Molecular Weight: 341.41
• CAS Registry Number: 36284-37-4
• SMILES: C1=C(C(=C3C2=C1CCN(C2CC4=C3C(=C(OC)C=C4)O)C)OC)OC
• InChI: 1S/C20H23NO4/c1-21-8-7-12-10-15(24-3)20(25-4)18-16(12)13(21)9-11-5-6-14(23-2)19(22)17(11)18/h5-6,10,13,22H,7-9H2,1-4H3
• InChIKey: QELDJEKNFOQJOY-UHFFFAOYSA-N

Properties

• Density: 1.223g/cm³ (Cal.)
• Boiling point: 506.055°C at 760 mmHg (Cal.)
• Flash point: 259.853°C (Cal.)

References

• (1): Over et al.. Natural-product-derived fragments for fragment-based ligand discovery, Nature Chemistry, 2012