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(Q82931510)
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English
1-Deoxy-1-(3,4-dimethylanilino)pentitol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
255.147058152
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₂₁NO₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
Cc1ccc(NCC(O)C(O)C(O)CO)cc1C
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C13H21NO4/c1-8-3-4-10(5-9(8)2)14-6-11(16)13(18)12(17)7-15/h3-5,11-18H,6-7H2,1-2H3
0 references
InChIKey
ZPFOXBJGVIUHDO-UHFFFAOYSA-N
0 references
CAS Registry Number
3051-94-3
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DSSTox substance ID
DTXSID70952825
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DSSTOX compound identifier
DTXCID101380898
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NSC number
19654
0 references
122032
0 references
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