$85.00
| CAS No.: | 5853-29-2 |
| Molecular Formula | C₂₈H₄₀Cl₂N₂O₄ |
| Molecular Weight | 539.5g/mol |
| Purity | HPLC>98% |
| Chemical Family | Alkaloids |
| Weight |
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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
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
InChIKey: YAOHSWWVTZSRQM-JBKGYMEJSA-N
Canonical SMILES: CCC1CN2CCC3=CC(=C(C=C3C2CC1CC4C5=CC(=C(C=C5CCN4)O)OC)OC)OC.Cl.Cl
Isomeric SMILES: CC[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@@H]1C[C@@H]4C5=CC(=C(C=C5CCN4)O)OC)OC)OC.Cl.Cl
Synonyms: 5853-29-2; CEPHAELINE DIHYDROCHLORIDE; (-)-Cephaeline dihydrochloride; CEPHAELINE HCL; Cephaleine hydrochloride; Cephaeline, dihydrochloride; Cephaeline (dihydrochloride); NSC 32944; …
Botanical Source: Ipecacuanha
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