Molecule ID: 440589

IUPAC Name: 15-methoxy-24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14,16,21-octaene

Description: The molecule is a benzophenanthridine alkaloid that is dihydrosanguinarine bearing a methoxy substituent at position 10. It has a role as a metabolite. It derives from a dihydrosanguinarine.

SMILES: COc1cc2c(c3c1-c1ccc4cc5c(cc4c1N(C)C3)OCO5)OCO2

SELFIES: [C][O][C][=C][C][=C][Branch2][Ring1][P][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][C][=Branch1][#C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][N][Branch1][C][C][C][Ring1][#C][O][C][O][Ring1][O][O][C][O][Ring2][Ring1][#Branch1]

InChI: InChI=1S/C21H17NO5/c1-22-8-14-19(17(23-2)7-18-21(14)27-10-26-18)12-4-3-11-5-15-16(25-9-24-15)6-13(11)20(12)22/h3-7H,8-10H2,1-2H3

Molecular Properties:
- Polar Surface Area: 49.4 Ų
- LogP: 4.1