CHEBI:193238 - 5,6,7-trihydroxy-2-(3-hydroxy-5-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one

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ChEBI Name 5,6,7-trihydroxy-2-(3-hydroxy-5-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one
ChEBI ID CHEBI:193238
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H14O7
Net Charge 0
Average Mass 318.281
Monoisotopic Mass 318.07395
InChI InChI=1S/C16H14O7/c1-22-9-3-7(2-8(17)4-9)12-5-10(18)14-13(23-12)6-11(19)15(20)16(14)21/h2-4,6,12,17,19-21H,5H2,1H3
InChIKey JNTVJZAORREEKF-UHFFFAOYSA-N
SMILES O1C(CC(=O)C2=C1C=C(O)C(O)=C2O)C=3C=C(OC)C=C(O)C3
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in feces (BTO:0000440). See: MetaboLights Study
ChEBI Ontology
Outgoing 5,6,7-trihydroxy-2-(3-hydroxy-5-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one (CHEBI:193238) is a ether (CHEBI:25698)
5,6,7-trihydroxy-2-(3-hydroxy-5-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one (CHEBI:193238) is a flavonoids (CHEBI:72544)
IUPAC Name
5,6,7-trihydroxy-2-(3-hydroxy-5-methoxyphenyl)-2,3-dihydrochromen-4-one
Manual Xref Database
74852149 ChemSpider
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