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(Q82543402)
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English
S-(2-Amino-2-carboxyethyl)-D-homocysteine
chemical compound
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No label defined
No description defined
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
222.067427928
dalton
1 reference
based on heuristic
inferred from SMILES
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
NC(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?/m1/s1
0 references
InChIKey
ILRYLPWNYFXEMH-CNZKWPKMSA-N
0 references
CAS Registry Number
6899-07-6
0 references
PubChem CID
23615398
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
ILRYLPWNYFXEMH-CNZKWPKMSA-N
SureChEMBL ID
SCHEMBL1158215
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ILRYLPWNYFXEMH-CNZKWPKMSA-N
UniChem compound ID
25768128
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30635182
1 reference
matched by identifier from
InChIKey
InChIKey
ILRYLPWNYFXEMH-CNZKWPKMSA-N
DSSTOX compound identifier
DTXCID50585933
0 references
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