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CHEBI:161936 - bispyribac(1−)

Default Structure
ChEBI IDCHEBI:161936
ChEBI Namebispyribac(1−)
Stars
ASCII Namebispyribac(1-)
DefinitionA monocarboxylic acid anion that is the conjugate base of bispyribac, arising from the deprotonation of the carboxy group. Major species at pH 7.3.
Last Modified6 November 2020
SubmitterAdnan
DownloadsMolfile
FormulaC19H17N4O8
Net Charge-1
Average Mass429.365
Monoisotopic Mass429.10519
SMILESCOc1cc(OC)nc(Oc2cccc(Oc3nc(OC)cc(OC)n3)c2C(=O)[O-])n1
InChIInChI=1S/C19H18N4O8/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4/h5-9H,1-4H3,(H,24,25)/p-1
InChIKeyRYVIXQCRCQLFCM-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
bispyribac(1−) (CHEBI:161936) is a monocarboxylic acid anion (CHEBI:35757)
bispyribac(1−) (CHEBI:161936) is conjugate base of bispyribac (CHEBI:3129)
Incoming Relation(s)
bispyribac-sodium (CHEBI:81757) has part bispyribac(1−) (CHEBI:161936)
bispyribac (CHEBI:3129) is conjugate acid of bispyribac(1−) (CHEBI:161936)
IUPAC Name 
2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate
Synonym  Source
bispyribac anionChEBI