A heteropentacyclic isoquinoline alkaloid having a tertiary amino bridging group.
Identification
IUPAC Names
(5S,11S)-8,9-dimethoxy-14-methyl-5,6,11,12-tetrahydro-5,11-epiminobenzo[5',6']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxole
Molecular Formula
C20H21NO4
Mass
339.38500
Monoisotopic Mass
339.14706
Charge
0
InChI
InChI=1S/C20H21NO4/c1-21-15-5-12-7-19-20(25-10-24-19)9-14(12)16(21)4-11-6-17(22-2)18(23-3)8-13(11)15/h6-9,15-16H,4-5,10H2,1-3H3/t15-,16-/m0/s1
InChIKey
YTZIQRTXKBDFKM-HOTGVXAUSA-N
SMILES
COc1cc2C[C@@H]3N(C)[C@@H](Cc4cc5OCOc5cc34)c2cc1OC
Synonyms
(5S)-5,6,11,12-Tetrahydro-8,9-dimethoxy-14-methyl-benzo[5,6]cycloocta[1,2-f]-1,3-benzodioxol-5,11-imine
Eschscholtzidine