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English
(2R)-2-Amino-4-(2-aminophenyl)-4-oxobutanoic acid--sulfuric acid (1/1)
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
DL-kynurenine sulfate
1 reference
based on heuristic
inferred from InChIKey
mass
306.05217178799995
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
kynurenine sulfate
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₄N₂O₇S
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
Nc1ccccc1C(=O)CC(N)C(=O)O.O=S(=O)(O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
Nc1ccccc1C(=O)C[C@@H](N)C(=O)O.O=S(=O)(O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C10H12N2O3.H2O4S/c11-7-4-2-1-3-6(7)9(13)5-8(12)10(14)15;1-5(2,3)4/h1-4,8H,5,11-12H2,(H,14,15);(H2,1,2,3,4)/t8-;/m1./s1
0 references
InChIKey
KAXRWMOLNJZCEW-DDWIOCJRSA-N
0 references
CAS Registry Number
19185-26-3
1 reference
InChIKey
KAXRWMOLNJZCEW-DDWIOCJRSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=19185-26-3
PubChem CID
70700673
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
KAXRWMOLNJZCEW-DDWIOCJRSA-N
UniChem compound ID
55993639
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70743477
1 reference
matched by identifier from
InChIKey
InChIKey
KAXRWMOLNJZCEW-DDWIOCJRSA-N
DSSTOX compound identifier
DTXCID00694221
0 references
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