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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:70453 - Dillapiole
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ChEBI Ontology
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ChEBI Name
Dillapiole
ChEBI ID
CHEBI:70453
Definition
A natural product found in
Anethum graveolens
.
Stars
This entity has been manually annotated by a third party.
Secondary ChEBI IDs
CHEBI:4600
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Formulae
C12H14O4
C12H14O4
Net Charge
0
Average Mass
222.23720
Monoisotopic Mass
222.08921
InChI
InChI=1S/C12H14O4/c1-4-5-8-6-9-11(16-7-15-9)12(14-3)10(8)13-2/h4,6H,1,5,7H2,2-3H3
InChIKey
LIKYNOPXHGPMIH-UHFFFAOYSA-N
SMILES
COc1c(CC=C)cc2OCOc2c1OC
Metabolite of Species
Details
Anethum graveolens
(NCBI:txid40922)
Found in seed
(BTO:0001226)
. Essential seed oil See:
PubMed
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Dillapiole (
CHEBI:70453
)
has role
metabolite (
CHEBI:25212
)
Dillapiole (
CHEBI:70453
)
is a
benzodioxoles (
CHEBI:38298
)
Synonyms
Sources
4,5-Dimethoxy-6-(2-propenyl)-1,3-benzodioxole
ChEBI
Dillapiol
KEGG COMPOUND
Dillapiole
KEGG COMPOUND
Manual Xrefs
Databases
C00002737
KNApSAcK
C10449
KEGG COMPOUND
HMDB0030725
HMDB
View more database links
Registry Number
Type
Source
484-31-1
CAS Registry Number
KEGG COMPOUND
Citation
Type
Source
21049975
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:methoxybenzene(CHEBI:51683); ISA:aromatic ether(CHEBI:35618); ISA:acetal(CHEBI:59769);