Coronaridine

methyl (1S,15S,17S,18S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate

Also Known As: CORONARIDINE|Coronardine|(-)-Coronaridine|Indole alkaloid derivative|methyl ethyl[?]carboxylate|Methyl ibogamine-18-carboxylate|EINECS 207-398-7|methyl(2|A)-ibogamine-18-carboxylate|Ibogamine-18-carboxylic acid, methyl ester|methyl (1S,15S,17S,18S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate|(3R,4aR,12bS)-9-[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]-3,4a,8,12b-tetrahydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione|methyl (1S,15R,17S,18S)-17-ethyl-3,13-diazapentacyclo(13.3.1.02,10.04,9.013,18)nonadeca-2(10),4,6,8-tetraene-1-carboxylate|methyl (1S,15S,17S,18S)-17-ethyl-3,13-diazapentacyclo(13.3.1.02,10.04,9.013,18)nonadeca-2(10),4,6,8-tetraene-1-carboxylate

Molecular Formula	C21H26N2O2
Molecular Weight	338.19943 g/mol
LogP	3.26
Topological Polar Surface Area	45.33 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	338.19943
Heavy Atoms	25
Complexity	841.5

Chemical Identifiers

CAS Number	467-77-6
SMILES	CC[C@H]1C[C@H]2C[C@@]3([C@H]1N(C2)CCC4=C3NC5=CC=CC=C45)C(=O)OC