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CHEBI:136934 - 2-trans-4'-dihydroabscisic acid

ChEBI IDCHEBI:136934
ChEBI Name2-trans-4'-dihydroabscisic acid
Stars
ASCII Name2-trans-4'-dihydroabscisic acid
DefinitionAn apo carotenoid sesquiterpenoid that is 2-trans-abscisic acid in which the keto group at position 4' has been reduced to the corresponding alcohol.
Last Modified18 April 2018
Submittermwilliams
DownloadsMolfile
FormulaC15H22O4
Net Charge0
Average Mass266.337
Monoisotopic Mass266.15181
SMILESCC1=CC(O)CC(C)(C)C1(O)/C=C/C(C)=C/C(=O)O
InChIInChI=1S/C15H22O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,12,16,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7+
InChIKeyMWGXQVSTMXPXIW-WEYXYWBQSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702)
- MetaboLights (MTBLS272)
- PubMed (27656890)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
Arabidopsis thaliana metabolite  Any plant metabolite that is produced by Arabidopsis thaliana.
ChEBI Ontology
Outgoing Relation(s)
2-trans-4'-dihydroabscisic acid (CHEBI:136934) has role Arabidopsis thaliana metabolite (CHEBI:140602)
2-trans-4'-dihydroabscisic acid (CHEBI:136934) is a apo carotenoid sesquiterpenoid (CHEBI:36758)
2-trans-4'-dihydroabscisic acid (CHEBI:136934) is a secondary allylic alcohol (CHEBI:134396)
2-trans-4'-dihydroabscisic acid (CHEBI:136934) is a tertiary allylic alcohol (CHEBI:134397)
2-trans-4'-dihydroabscisic acid (CHEBI:136934) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
IUPAC Name 
(2E,4E)-5-(1,4-dihydroxy-2,6,6-trimethylcyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid
Synonym  Source
4'-dihydroabscisic acidChEBI
Manual XrefsDatabases
14923529ChemSpider
HMDB0039516HMDB
Registry NumbersSources
Reaxys:2946155Reaxys
CAS:84026-26-6HMDB