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(Q5027)
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Revision as of 16:49, 15 November 2024 by
Egonw
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Statements
instance of
type of a chemical entity
0 references
SMILES
N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(O)=O
0 references
chemical formula
C₁₅H₁₂I₃NO₄
1 reference
based on heuristic
inferred from SMILES
mass
650.9741
1 reference
based on heuristic
inferred from SMILES
InChI
InChI=1S/C15H12I3NO4/c16-9-6-8(1-2-13(9)20)23-14-10(17)3-7(4-11(14)18)5-12(19)15(21)22/h1-4,6,12,20H,5,19H2,(H,21,22)/t12-/m0/s1
1 reference
based on heuristic
inferred from SMILES
InChIKey
AUYYCJSJGJYCDS-LBPRGKRZSA-N
1 reference
based on heuristic
inferred from SMILES