9'-hydroxyabscisic acid (CHEBI:85162)

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ChEBI Name	9'-hydroxyabscisic acid

ChEBI ID	CHEBI:85162

Definition	An oxo monocarboxylic acid that is (+)-abscisic acid substituted by a hydroxy group at position 9'.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C15H20O5

Net Charge

Average Mass

280.31630

Monoisotopic Mass

280.13107

InChI

InChI=1S/C15H20O5/c1-10(6-13(18)19)4-5-15(20)11(2)7-12(17)8-14(15,3)9-16/h4-7,16,20H,8-9H2,1-3H3,(H,18,19)/b5-4+,10-6-/t14-,15+/m0/s1

InChIKey

AVFORCKFTWHFAR-QOMXHDIWSA-N

SMILES

C\C(\C=C\[C@@]1(O)C(C)=CC(=O)C[C@@]1(C)CO)=C\C(O)=O

Metabolite of Species	Details
Centella asiatica (NCBI:txid48106)	See: MetaboLights Study

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	9'-hydroxyabscisic acid (CHEBI:85162) has functional parent (+)-abscisic acid (CHEBI:2365) 9'-hydroxyabscisic acid (CHEBI:85162) has role plant metabolite (CHEBI:76924) 9'-hydroxyabscisic acid (CHEBI:85162) is a oxo monocarboxylic acid (CHEBI:35871) 9'-hydroxyabscisic acid (CHEBI:85162) is a primary alcohol (CHEBI:15734) 9'-hydroxyabscisic acid (CHEBI:85162) is a tertiary alcohol (CHEBI:26878)

IUPAC Name

(2Z,4E)-5-[(1R,6S)-1-hydroxy-6-(hydroxymethyl)-2,6-dimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid

Synonym	Source
9'-HOABA	MetaCyc

Last Modified

09 March 2015