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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:63559 - HBOA
Main
ChEBI Ontology
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ChEBI Name
HBOA
ChEBI ID
CHEBI:63559
Definition
A benzoxazine bearing hydroxy and oxo substituents at positions 2 and 3 respectively.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
Supplier Information
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Formula
C8H7NO3
Net Charge
0
Average Mass
165.14610
Monoisotopic Mass
165.04259
InChI
InChI=1S/C8H7NO3/c10-7-8(11)12-6-4-2-1-3-5(6)9-7/h1-4,8,11H,(H,9,10)
InChIKey
VMQBFYRBJKDACN-UHFFFAOYSA-N
SMILES
OC1Oc2ccccc2NC1=O
Metabolite of Species
Details
Aphelandra tetragona
(NCBI:txid328118)
Found in root
(BTO:0001188)
. See:
PubMed
Roles Classification
Biological Role
(s):
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
HBOA (
CHEBI:63559
)
has role
allelochemical (
CHEBI:62215
)
HBOA (
CHEBI:63559
)
has role
plant metabolite (
CHEBI:76924
)
HBOA (
CHEBI:63559
)
is a
benzoxazine (
CHEBI:46969
)
HBOA (
CHEBI:63559
)
is a
lactam (
CHEBI:24995
)
HBOA (
CHEBI:63559
)
is a
lactol (
CHEBI:38131
)
Incoming
HMBOA β-
D
-glucoside (
CHEBI:134457
)
has functional parent
HBOA (
CHEBI:63559
)
IUPAC Name
2-hydroxy-2
H
-1,4-benzoxazin-3(4
H
)-one
Synonyms
Sources
2-Hydroxy-1,4-benzoxazin-3-one
KEGG COMPOUND
2-hydroxy-2
H
-1,4-benzoxazin-3(4
H
)-one
UniProt
Manual Xrefs
Databases
C00036489
KNApSAcK
C15769
KEGG COMPOUND
CPD-6364
MetaCyc
View more database links
Registry Numbers
Types
Sources
149851
Reaxys Registry Number
Reaxys
23520-34-5
CAS Registry Number
KNApSAcK
Citations
Types
Sources
10385992
PubMed citation
SUBMITTER
10680174
PubMed citation
Europe PMC
11393516
PubMed citation
Europe PMC
12240993
PubMed citation
Europe PMC
12324332
PubMed citation
Europe PMC
14595855
PubMed citation
Europe PMC
15241920
PubMed citation
Europe PMC
16042337
PubMed citation
Europe PMC
16478218
PubMed citation
Europe PMC
16668055
PubMed citation
Europe PMC
17681563
PubMed citation
Europe PMC
21214244
PubMed citation
Europe PMC
Last Modified
18 January 2019