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(Q82046707)
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NSC149022
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
312.070598724
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₁₂N₄O₇
0 references
canonical SMILES
CC(=O)OCCNC1=C(C=C(C(=C1)C(=O)N)[N+](=O)[O-])[N+](=O)[O-]
0 references
Identifiers
InChI
InChI=1S/C11H12N4O7/c1-6(16)22-3-2-13-8-4-7(11(12)17)9(14(18)19)5-10(8)15(20)21/h4-5,13H,2-3H2,1H3,(H2,12,17)
0 references
InChIKey
SMOJGELYULWUBG-UHFFFAOYSA-N
0 references
CAS Registry Number
56820-40-7
0 references
PubChem CID
288263
1 reference
matched by identifier from
InChIKey
InChIKey
SMOJGELYULWUBG-UHFFFAOYSA-N
UniChem compound ID
63248504
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80302150
1 reference
matched by identifier from
InChIKey
InChIKey
SMOJGELYULWUBG-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30253284
0 references
NSC number
149022
0 references
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