LOBELINE SULFATE(134-64-5) IR1
Product NameLOBELINE SULFATE
CAS134-64-5
Molecular FormulaC44H56N2O8S
Molecular Weight772.99
InChIInChI=1/2C22H27NO2.H2O4S/c2*1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18;1-5(2,3)4/h2*2-7,9-12,19-21,24H,8,13-16H2,1H3;(H2,1,2,3,4)/t2*19-,20+,21-;/s3
InChIKey GRZMOSSVIPFGFF-ZJDVGHDANA-N
Smiles[C@H]1(CCC[C@H](CC(=O)C2=CC=CC=C2)N1C)C[C@H](O)C1=CC=CC=C1.[C@H]1(CCC[C@H](CC(=O)C2=CC=CC=C2)N1C)C[C@H](O)C1=CC=CC=C1.S(=O)(=O)(O)O |&1:0,4,17,25,29,42,r|
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Spectral Code: IR : KBr disc