DIBOA (CHEBI:63558)

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ChEBI Name	DIBOA

ChEBI ID	CHEBI:63558

Definition	A lactol that consists of 1,4-benzoxazine bearing two hydroxy substituents at positions 2 and 4 as well as a keto group at position 3.

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

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C8H7NO4

Net Charge

Average Mass

181.14550

Monoisotopic Mass

181.03751

InChI

InChI=1S/C8H7NO4/c10-7-8(11)13-6-4-2-1-3-5(6)9(7)12/h1-4,8,11-12H

InChIKey

COVOPZQGJGUPEY-UHFFFAOYSA-N

SMILES

OC1Oc2ccccc2N(O)C1=O

Metabolite of Species	Details
Aphelandra tetragona (NCBI:txid328118)	Found in root (BTO:0001188). See: PubMed

Roles Classification
Biological Role(s):	phytotoxin Any toxin produced by a plant. allelochemical A class of secondary metabolites developed by many plants to influence the behaviour, growth or survival of herbivores, and thus acting as a defence against herbivory. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

Application(s):	herbicide A substance used to destroy plant pests.

ChEBI Ontology
Outgoing	DIBOA (CHEBI:63558) has role allelochemical (CHEBI:62215) DIBOA (CHEBI:63558) has role herbicide (CHEBI:24527) DIBOA (CHEBI:63558) has role phytotoxin (CHEBI:38231) DIBOA (CHEBI:63558) has role plant metabolite (CHEBI:76924) DIBOA (CHEBI:63558) is a benzoxazine (CHEBI:46969) DIBOA (CHEBI:63558) is a cyclic hydroxamic acid (CHEBI:23445) DIBOA (CHEBI:63558) is a lactol (CHEBI:38131)

Incoming	DIBOA β-D-glucoside (CHEBI:63670) has functional parent DIBOA (CHEBI:63558) DIMBOA (CHEBI:18048) has functional parent DIBOA (CHEBI:63558)

IUPAC Name

2,4-dihydroxy-2H-1,4-benzoxazin-3(4H)-one

Last Modified

18 January 2019