Product Information
Chemical Data
Analyte Name
Ibogamine-18-carboxylic Acid Methyl Ester
CAS Number
467-77-6
Molecular Formula
C21 H26 N2 O2
Molecular Weight
338.443
Accurate Mass
338.199
SMILES
CC[C@H]1C[C@H]2C[N@@]3CCc4c([nH]c5ccccc45)[C@](C2)([C@H]13)C(=O)OC
InChI
InChI=1S/C21H26N2O2/c1-3-14-10-13-11-21(20(24)25-2)18-16(8-9-23(12-13)19(14)21)15-6-4-5-7-17(15)22-18/h4-7,13-14,19,22H,3,8-12H2,1-2H3/t13-,14+,19+,21-/m1/s1
IUPAC
methyl (1S,13S,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
Product Data
Country of Origin
CANADA
Product Format
Neat