CHEBI:2373 - acamelin

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ChEBI Name acamelin
ChEBI ID CHEBI:2373
Definition A member of the class of 1-benzofurans that is 1-benzofuran-4,7-dione bearing additional methyl and methoxy substituents at positions 2 and 7 respectively.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C10H8O4
Net Charge 0
Average Mass 192.169
Monoisotopic Mass 192.04226
InChI InChI=1S/C10H8O4/c1-5-3-6-7(11)4-8(13-2)9(12)10(6)14-5/h3-4H,1-2H3
InChIKey DNQLVCZXYPFUHF-UHFFFAOYSA-N
SMILES O1C2=C(C=C1C)C(C=C(C2=O)OC)=O
ChEBI Ontology
Outgoing acamelin (CHEBI:2373) is a 1-benzofurans (CHEBI:38830)
acamelin (CHEBI:2373) is a p-quinones (CHEBI:25830)
IUPAC Name
6-methoxy-2-methyl-1-benzofuran-4,7-dione
Synonym Source
Acamelin KEGG COMPOUND
Manual Xrefs Databases
C00002784 KNApSAcK
C10290 KEGG COMPOUND
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Registry Numbers Types Sources
4672741 Reaxys Registry Number Reaxys
74161-27-6 CAS Registry Number ChemIDplus
Last Modified
03 June 2016