CHEBI:205400 - 2-hydroxy-2,4-dimethyl-3(2H)-benzofuranone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 2-hydroxy-2,4-dimethyl-3(2H)-benzofuranone
ChEBI ID CHEBI:205400
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H10O3
Net Charge 0
Average Mass 178.187
Monoisotopic Mass 178.06299
InChI InChI=1S/C10H10O3/c1-6-4-3-5-7-8(6)9(11)10(2,12)13-7/h3-5,12H,1-2H3/t10-/m0/s1
InChIKey XZTWUMWIHHLFDI-JTQLQIEISA-N
SMILES O=C1C2=C(C=CC=C2O[C@@]1(O)C)C
Metabolite of Species Details
Paraphaeosphaeria minitans (NCBI:txid565426) See: DOI
ChEBI Ontology
Outgoing 2-hydroxy-2,4-dimethyl-3(2H)-benzofuranone (CHEBI:205400) is a benzofurans (CHEBI:35259)
IUPAC Name
2-hydroxy-2,4-dimethyl-1-benzouran-3-one
Manual Xref Database
60686325 ChemSpider
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