Emetine, dihydrochloride, hydrate

CAS Registry Number®

7083-71-8

CAS Name

Emetine, dihydrochloride, hydrate

Molecular Formula

C29H40N2O4.2ClH.xH2O

Cite this Page

Emetine, dihydrochloride, hydrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7083-71-8 (retrieved 2024-11-22) (CAS RN: 7083-71-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C29H40N2O4.2ClH.H2O/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24;;;/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3;2*1H;1H2/t18-,21-,24+,25-;;;/m0.../s1

InChIKey

InChIKey=IZTPMTAWOCEKKM-VXMYZLRESA-N

SMILES

C([C@H]1C[C@]2(C=3C(=CC(OC)=C(OC)C3)CCN2C[C@@H]1CC)[H])[C@@H]4C=5C(=CC(OC)=C(OC)C5)CCN4.Cl.O

Canonical SMILES

Cl.O.O(C=1C=C2C(=CC1OC)C(NCC2)CC3CC4C5=CC(OC)=C(OC)C=C5CCN4CC3CC)C

Other Names for this Substance

  • 2H-Benzo[a]quinolizine, 3-ethyl-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2-[[(1R)-1,2,3,4-tetrahydro-6,7-dimethoxy-1-isoquinolinyl]methyl]-, hydrochloride, hydrate (1:2:?), (2S,3R,11bS)-
  • Emetine, dihydrochloride, hydrate
  • Emetan, 6′,7′,10,11-tetramethoxy-, dihydrochloride, hydrate
  • 2H-Benzo[a]quinolizine, emetan deriv.
  • Emetine hydrochloride hydrate

CAS INSIGHTSTM
Hourglass and a clock