CHEBI:223348 - 3-methyltrichosorbicillin H

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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 3-methyltrichosorbicillin H
ChEBI ID CHEBI:223348
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H14O5
Net Charge 0
Average Mass 238.239
Monoisotopic Mass 238.08412
InChI InChI=1S/C12H14O5/c1-6-5-8(9(13)3-4-10(14)15)12(17)7(2)11(6)16/h5,16-17H,3-4H2,1-2H3,(H,14,15)
InChIKey ZEDVDABKFUUNGR-UHFFFAOYSA-N
SMILES O=C(O)CCC(=O)C1=C(O)C(=C(O)C(=C1)C)C
Metabolite of Species Details
Trichoderma (NCBI:txid5543) See: PubMed
ChEBI Ontology
Outgoing 3-methyltrichosorbicillin H (CHEBI:223348) is a aromatic ketone (CHEBI:76224)
IUPAC Name
4-(2,4-dihydroxy-3,5-dimethylphenyl)-4-oxobutanoic acid
Manual Xref Database
73930418 ChemSpider
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