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CHEBI:62426 - 2-trans-abscisic acid

ChEBI IDCHEBI:62426
ChEBI Name2-trans-abscisic acid
Stars
ASCII Name2-trans-abscisic acid
DefinitionAn abscisic acid in which the two acyclic double bonds both have trans-geometry.
Last Modified20 April 2017
SubmitterGareth Owen
DownloadsMolfile
FormulaC15H20O4
Net Charge0
Average Mass264.321
Monoisotopic Mass264.13616
SMILESCC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)=C/C(=O)O
InChIInChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7+
InChIKeyJLIDBLDQVAYHNE-WEYXYWBQSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-trans-abscisic acid (CHEBI:62426) is a abscisic acids (CHEBI:62431)
2-trans-abscisic acid (CHEBI:62426) is conjugate acid of 2-trans-abscisate (CHEBI:62429)
Incoming Relation(s)
2-trans-abscisic acid D-glucosyl ester (CHEBI:133910) has functional parent 2-trans-abscisic acid (CHEBI:62426)
(R)-2-trans-abscisic acid (CHEBI:18657) is a 2-trans-abscisic acid (CHEBI:62426)
(S)-2-trans-abscisic acid (CHEBI:18743) is a 2-trans-abscisic acid (CHEBI:62426)
2-trans-abscisate (CHEBI:62429) is conjugate base of 2-trans-abscisic acid (CHEBI:62426)
IUPAC Name 
(2E,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid
Synonym  Source
2-trans-ABAChEBI