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(Q82006522)
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English
Naphthoxylactic acid
chemical compound
2-Hydroxy-3-[(naphthalen-1-yl)oxy]propanoic acid
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
232.073558864
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₂O₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
O=C(O)C(O)COc1cccc2ccccc12
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C13H12O4/c14-11(13(15)16)8-17-12-7-3-5-9-4-1-2-6-10(9)12/h1-7,11,14H,8H2,(H,15,16)
0 references
InChIKey
CFQFHRDQYGTGFA-UHFFFAOYSA-N
0 references
CAS Registry Number
94537-05-0
reason for deprecated rank
cannot be confirmed by other sources
0 references
10476-54-7
reason for deprecated rank
cannot be confirmed by other sources
0 references
PubChem CID
115274
1 reference
matched by identifier from
InChIKey
InChIKey
CFQFHRDQYGTGFA-UHFFFAOYSA-N
UniChem compound ID
26410501
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90276156
1 reference
matched by identifier from
InChIKey
InChIKey
CFQFHRDQYGTGFA-UHFFFAOYSA-N
DTXSID90909174
1 reference
matched by identifier from
InChIKey
InChIKey
CFQFHRDQYGTGFA-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20227499
0 references
DTXCID60876420
0 references
Human Metabolome Database ID
HMDB0255452
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CFQFHRDQYGTGFA-UHFFFAOYSA-N
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