CHEBI:226462 - Emerimidine A

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Emerimidine A
ChEBI ID CHEBI:226462
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H11NO4
Net Charge 0
Average Mass 209.201
Monoisotopic Mass 209.06881
InChI InChI=1S/C10H11NO4/c1-14-7-3-5-6(4-11-10(5)13)8(12)9(7)15-2/h3,12H,4H2,1-2H3,(H,11,13)
InChIKey WPPQGGXKHNJQJP-UHFFFAOYSA-N
SMILES O=C1NCC2=C1C=C(OC)C(=C2O)OC
Metabolite of Species Details
Aspergillusspecies HK-ZJ (NCBI:txid713472) See: PubMed
ChEBI Ontology
Outgoing Emerimidine A (CHEBI:226462) is a isoindoles (CHEBI:24897)
IUPAC Name
4-hydroxy-5,6-dimethoxy-2,3-dihydroisoindol-1-one
Manual Xref Database
27022407 ChemSpider
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