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Concept information

Preferred term

C646  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

alt_id

  • CHEBI:95029

charge

  • 0

formula

  • C24H19N3O6

has_role

inchi

  • InChI=1S/C24H19N3O6/c1-13-10-20(21(27(31)32)11-14(13)2)22-9-8-18(33-22)12-19-15(3)25-26(23(19)28)17-6-4-16(5-7-17)24(29)30/h4-12H,1-3H3,(H,29,30)

inchikey

  • HEKJYZZSCQBJGB-UHFFFAOYSA-N

mass

  • 445.425

monoisotopicmass

  • 445.12739

smiles

  • C(=C1C(N(N=C1C)C2=CC=C(C(=O)O)C=C2)=O)([H])C=3OC(=CC3)C4=CC(=C(C=C4[N+]([O-])=O)C)C

subset

  • 3_STAR

synonym EXACT

  • 4-(4-{[5-(4,5-dimethyl-2-nitrophenyl)-2-furyl]methylene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:132974

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