16-Epi-isositsirikine

CAS	6519-27-3
Synonyms	(16R)-E-Isositsirikine
IUPAC Name	methyl (2R)-2-[(2R,3E,12bS)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-hydroxypropanoate
Molecular Weight	354.45
Molecular Formula	C21H26N2O3
Canonical SMILES	C/C=C\1/CN2CCC3=C([C@@H]2C[C@@H]1[C@H](CO)C(=O)OC)NC4=CC=CC=C34
InChI	InChI=1S/C21H26N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h3-7,16-17,19,22,24H,8-12H2,1-2H3/b13-3-/t16-,17-,19-/m0/s1
InChI Key	RGXKJLTVROJBKZ-LZNZQLKFSA-N
Boiling Point	558.9±50.0 °C
Melting Point	263.5 °C
Purity	98%
Density	1.26±0.1 g/ml
Appearance	Solid