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(Q83004786)
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English
Amino(3,4,5-trihydroxy-3,4-dihydro-2H-pyrrol-2-yl)acetaldehyde
group of stereoisomers with the chemical formula C₆H₁₀N₂O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
174.0640568
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₆H₁₀N₂O₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
NC(C=O)C1N=C(O)C(O)C1O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
NC(C=O)[C@H]1NC(=O)[C@@H](O)[C@H]1O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C6H10N2O4/c7-2(1-9)3-4(10)5(11)6(12)8-3/h1-5,10-11H,7H2,(H,8,12)/t2?,3-,4+,5+/m1/s1
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InChIKey
OXSJRTPNEMJVKX-UOODXVIRSA-N
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CAS Registry Number
88760-87-6
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PubChem CID
192225
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
52120961
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID701008357
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DSSTOX compound identifier
DTXCID901435196
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