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(Q82877370)
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English
9,10-Dimethoxy-7-methyl-7-oxo-6,7,7a,8-tetrahydro-2H,5H-7lambda~5~-[1,3]benzodioxolo[6,5,4-de]benzo[g]quinoline
group of stereoisomers with the chemical formula C₂₀H₂₁NO₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
355.14197277200003
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₁NO₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
COc1ccc2c(c1OC)CC1c3c(cc4c(c3-2)OCO4)CC[N+]1(C)[O-]
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COc1ccc2c(c1OC)CC1c3c(cc4c(c3-2)OCO4)CC[N@@+]1(C)[O-]
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C20H21NO5/c1-21(22)7-6-11-8-16-20(26-10-25-16)18-12-4-5-15(23-2)19(24-3)13(12)9-14(21)17(11)18/h4-5,8,14H,6-7,9-10H2,1-3H3/t14?,21-/m1/s1
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InChIKey
FCZORVXRVVKVLF-OKKPIIHCSA-N
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CAS Registry Number
102719-85-7
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PubChem CID
128190
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
42576614
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60908018
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DSSTOX compound identifier
DTXCID401337105
0 references
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