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(Q82923580)
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English
4-Chloro-N-(1-hydroxyethylidene)phenylalanine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
241.050570924
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₁₂ClNO₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(=O)NC(Cc1ccc(Cl)cc1)C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C11H12ClNO3/c1-7(14)13-10(11(15)16)6-8-2-4-9(12)5-3-8/h2-5,10H,6H2,1H3,(H,13,14)(H,15,16)
0 references
InChIKey
HLORMWAKCPDIPU-UHFFFAOYSA-N
0 references
CAS Registry Number
23434-92-6
1 reference
InChIKey
HLORMWAKCPDIPU-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=23434-92-6
PubChem CID
602662
1 reference
matched by identifier from
InChIKey
InChIKey
HLORMWAKCPDIPU-UHFFFAOYSA-N
DSSTox substance ID
DTXSID90946089
1 reference
matched by identifier from
InChIKey
InChIKey
HLORMWAKCPDIPU-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID801374383
0 references
Human Metabolome Database ID
HMDB0243712
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HLORMWAKCPDIPU-UHFFFAOYSA-N
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