20S-Hydroxyconopharyngine

Catalog	BBC16790935
CAS	16790-93-5
Synonyms	Ibogamine-18-carboxylic acid, 20-hydroxy-12,13-dimethoxy-, methyl ester, (20S)- (9CI)
IUPAC Name	Methyl (1S,15R,17S,18S)-17-[(1S)-1-hydroxyethyl]-6,7-dimethoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate
Molecular Weight	414.5
Molecular Formula	C23H30N2O5
Canonical SMILES	C[C@@H]([C@H]1C[C@@H]2C[C@@]3([C@H]1N(C2)CCC4=C3NC5=CC(=C(C=C45)OC)OC)C(=O)OC)O
InChI	InChI=1S/C23H30N2O5/c1-12(26)15-7-13-10-23(22(27)30-4)20-14(5-6-25(11-13)21(15)23)16-8-18(28-2)19(29-3)9-17(16)24-20/h8-9,12-13,15,21,24,26H,5-7,10-11H2,1-4H3/t12-,13+,15+,21-,23+/m0/s1
InChI Key	RCDVEJINCXVEQG-UNJQAPKOSA-N
Boiling Point	560.3±50.0 °C
Purity	98%
Density	1.32±0.1 g/ml
Appearance	Solid
pKa	14.93±0.20