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(Q83110486)
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English
A 33853
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
391.3345
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₁₃N₃O₆
0 references
canonical SMILES
C1=CC(=C(C(=C1)O)NC(=O)C2=C(C=CC=N2)O)C3=NC4=C(C=CC=C4O3)C(=O)O
0 references
Identifiers
InChI
InChI=1S/C20H13N3O6/c24-12-6-1-4-10(15(12)22-18(26)17-13(25)7-3-9-21-17)19-23-16-11(20(27)28)5-2-8-14(16)29-19/h1-9,24-25H,(H,22,26)(H,27,28)
0 references
InChIKey
LJVDLJDWXVPUAB-UHFFFAOYSA-N
0 references
CAS Registry Number
80148-45-4
0 references
PubChem CID
133379
1 reference
matched by identifier from
InChIKey
InChIKey
LJVDLJDWXVPUAB-UHFFFAOYSA-N
UniChem compound ID
287769
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50230092
1 reference
matched by identifier from
InChIKey
InChIKey
LJVDLJDWXVPUAB-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID50152583
0 references
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