Eschscholtzidine

(1S,12S)-15,16-dimethoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaene

Also Known As: Eschscholtzidine|O-Mehtylcaryachine|(-)-Eschscholtzidine|(5S)-5,6,11,12-Tetrahydro-8,9-dimethoxy-14-methyl-benzo[5,6]cycloocta[1,2-f]-1,3-benzodioxol-5,11-imine|(1S,12S)-15,16-dimethoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaene|(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|(1S,12S)-15,16-dimethoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaene|(5S,11S)-8,9-Dimethoxy-14-methyl-5,6,11,12-tetrahydro-2H-5,11-epiminobenzo[5',6']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxole|(5S,11S)-8,9-Dimethoxy-14-methyl-5,6,11,12-tetrahydro-5,11-epiminobenzo[5,6]cycloocta[1,2-f][1,3]benzodioxole|8,9-Dimethoxy-14-methyl-5,6,11,12-tetrahydro-2H-5,11-epiminobenzo[5',6']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxole|Benzo(5,6)cycloocta(1,2-f)-1,3-benzodioxol-5,11-imine, 5,6,11,12-tetrahydro-8,9-dimethoxy-14-methyl-, (5S)-|Benzo[5,6]cycloocta[1,2-f]-1,3-benzodioxol-5,11-imine, 5,6,11,12-tetrahydro-8,9-dimethoxy-14-methyl-, (5S,11S)-

Molecular Formula	C20H21NO4
Molecular Weight	339.14706 g/mol
LogP	3.1
Topological Polar Surface Area	40.2 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	339.14706
Monoisotopic Mass	339.14706
Heavy Atoms	25
Complexity	502.0

Chemical Identifiers

CAS Number	6451-67-8
SMILES	CN1[C@H]2CC3=CC4=C(C=C3[C@@H]1CC5=CC(=C(C=C25)OC)OC)OCO4
InChIKey	YTZIQRTXKBDFKM-HOTGVXAUSA-N