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(Q83002917)
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English
2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)octahydro-2H-quinolizine
group of stereoisomers with the chemical formula C₂₄H₃₁NO₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
381.23039385199996
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₃₁NO₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
COc1ccc(C2CN3CCCCC3CC2c2ccc(OC)c(OC)c2)cc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COc1ccc([C@H]2CN3CCCCC3C[C@@H]2c2ccc(OC)c(OC)c2)cc1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C24H31NO3/c1-26-20-10-7-17(8-11-20)22-16-25-13-5-4-6-19(25)15-21(22)18-9-12-23(27-2)24(14-18)28-3/h7-12,14,19,21-22H,4-6,13,15-16H2,1-3H3/t19?,21-,22-/m1/s1
0 references
InChIKey
GMQYKWXEHFKAJW-CEAUUGKZSA-N
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CAS Registry Number
86688-02-0
0 references
PubChem CID
158987
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
62509673
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID001007027
0 references
DSSTOX compound identifier
DTXCID101433889
0 references
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