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D-allocystathionine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
S-(2-Amino-2-carboxyethyl)-D-homocysteine
1 reference
based on heuristic
inferred from SMILES
mass
222.067427928
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
L-cystathionine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
allocystathionine
1 reference
based on heuristic
inferred from InChI
L-cystathionine dizwitterion
1 reference
based on heuristic
inferred from InChI
chemical formula
C₇H₁₄N₂O₄S
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
NC(CCSCC(N)C(=O)O)C(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
N[C@H](CSCC[C@H](N)C(=O)O)C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5+/m0/s1
0 references
InChIKey
ILRYLPWNYFXEMH-CRCLSJGQSA-N
0 references
CAS Registry Number
2998-83-6
0 references
DSSTox substance ID
DTXSID10331433
0 references
DSSTOX compound identifier
DTXCID60282527
0 references
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