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(Q117338279)
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English
quinine methochloride
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
374.176105784
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₇ClN₂O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
C=CC1C[N+]2(C)CCC1CC2C(O)c1ccnc2ccc(OC)cc12.[Cl-]
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C=CC1C[N+]2(C)CCC1C[C@@H]2[C@@H](O)c1ccnc2ccc(OC)cc12.[Cl-]
1 reference
based on heuristic
inferred from InChI
subject has role
muscle relaxant
0 references
Identifiers
InChI
InChI=1S/C21H27N2O2.ClH/c1-4-14-13-23(2)10-8-15(14)11-20(23)21(24)17-7-9-22-19-6-5-16(25-3)12-18(17)19;/h4-7,9,12,14-15,20-21,24H,1,8,10-11,13H2,2-3H3;1H/q+1;/p-1/t14?,15?,20-,21+,23?;/m1./s1
0 references
InChIKey
JDGBARYFQADTHZ-KCWPWBDNSA-M
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
63717-11-3
0 references
ChemSpider ID
40616
0 references
PubChem CID
44638
0 references
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