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(Q82183137)
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English
AC1MHJ1F
group of stereoisomers with the chemical formula C₁₂H₁₆Cl₂N₂O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
354.038541592
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₆Cl₂N₂O₆
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
COC(c1cn(C2CC(O)C(CO)O2)c(=O)nc1O)C(Cl)Cl
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COC(c1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1O)C(Cl)Cl
1 reference
based on heuristic
inferred from InChI
catalog
CAS COVID-19 Anti-Viral Candidate Compounds
0 references
Identifiers
InChI
InChI=1S/C12H16Cl2N2O6/c1-21-9(10(13)14)5-3-16(12(20)15-11(5)19)8-2-6(18)7(4-17)22-8/h3,6-10,17-18H,2,4H2,1H3,(H,15,19,20)/t6-,7+,8+,9?/m0/s1
0 references
InChIKey
IAGUAHRHPOSRCK-VCWZQCKKSA-N
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CAS Registry Number
160109-86-4
0 references
PubChem CID
3005551
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
67190978
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40388278
0 references
DSSTOX compound identifier
DTXCID80339300
0 references
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