CHEBI:82031 - Primisulfuron

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ChEBI Name Primisulfuron
ChEBI ID CHEBI:82031
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C14H10F4N4O7S
Net Charge 0
Average Mass 454.31000
Monoisotopic Mass 454.02063
InChI InChI=1S/C14H10F4N4O7S/c15-11(16)28-8-5-9(29-12(17)18)20-13(19-8)21-14(25)22-30(26,27)7-4-2-1-3-6(7)10(23)24/h1-5,11-12H,(H,23,24)(H2,19,20,21,22,25)
InChIKey GPGLBXMQFQQXDV-UHFFFAOYSA-N
SMILES OC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1nc(OC(F)F)cc(OC(F)F)n1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Primisulfuron (CHEBI:82031) is a benzoic acids (CHEBI:22723)
Manual Xrefs Databases
535 PPDB
C18883 KEGG COMPOUND
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Registry Number Type Source
113036-87-6 CAS Registry Number KEGG COMPOUND