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(Q82744115)
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English
Acetic acid--benzene-1,2,3,5-tetrol (4/1)
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
382.11112614399997
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₂₂O₁₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.Oc1cc(O)c(O)c(O)c1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C6H6O4.4C2H4O2/c7-3-1-4(8)6(10)5(9)2-3;4*1-2(3)4/h1-2,7-10H;4*1H3,(H,3,4)
0 references
InChIKey
SXIZJKZWMLIKFJ-UHFFFAOYSA-N
0 references
CAS Registry Number
24924-09-2
0 references
PubChem CID
71356605
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
SXIZJKZWMLIKFJ-UHFFFAOYSA-N
UniChem compound ID
66219654
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60780735
1 reference
matched by identifier from
InChIKey
InChIKey
SXIZJKZWMLIKFJ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID50731478
0 references
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