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9'-hydroxyabscisic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM39479

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₁₅H₂₀O₅

charge

mass

280.13107

reference

InChIKey

AVFORCKFTWHFAR-QOMXHDIWSA-N

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

SMILES

CC1=CC(=O)C[C@@](C)(CO)[C@@]1(O)/C=C/C(C)=C\C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:85162 chebi:85162	9'-hydroxyabscisic acid (2Z,4E)-5-[(1R,6S)-1-hydroxy-6-(hydroxymethyl)-2,6-dimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid 9'-HOABA
seed.compound:cpd24846 seedM:cpd24846	9'-HOABA 9'-hydroxyabscisate 9'-hydroxyavscesic acid
metacyc.compound:CPD-7728 metacycM:CPD-7728	9'-hydroxyabscisate 9'-HOABA 9'-hydroxyavscesic acid
seedM:M_cpd24846	secondary/obsolete/fantasy identifier