CAS 5853-29-2 Cephaeline hydrochloride - Analytical Products / Alfa Chemistry

CAT	APS5853292
CAS	5853-29-2
Structure
Synonyms	(-)-Cephaeline dihydrochloride, Cephaeline, dihydrochloride (7CI,8CI), Cephaeline Dihydrochloride, Emetan-6'-ol, 7',10,11-trimethoxy-, dihydrochloride (9CI), NSC 32944,6-Isoquinolinol, 1-[[(2S,3R,11bS)-3-ethyl-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2H-benzo[a]quinolizin-2-yl]methyl]-1,2,3,4-tetrahydro-7-methoxy-, hydrochloride (1:2), (1R)-
IUPAC Name	(1R)-1-[[(2S,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-1,2,3,4-tetrahydroisoquinolin-6-ol;dihydrochloride
Molecular Weight	539.53
Molecular Formula	C28H38N2O4.2ClH
Canonical SMILES	Cl.Cl.CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@H]4NCCc5cc(O)c(OC)cc45
InChI	InChI=1S/C28H38N2O4.2ClH/c1-5-17-16-30-9-7-19-13-27(33-3)28(34-4)15-22(19)24(30)11-20(17)10-23-21-14-26(32-2)25(31)12-18(21)6-8-29-23;;/h12-15,17,20,23-24,29,31H,5-11,16H2,1-4H3;2*1H/t17-,20-,23+,24-;;/m0../s1

Accurate Mass	538.2365
API Family	Matrix - API Family See respective official monograph(s)
Format	Neat
Product Type	API
Shipping	Room Temperature
Storage Conditions	2-8°C Fridge/Coldroom
Subcategory	European Pharmacopoeia (Ph. Eur.)