DeepMet

Record Information
HMDB Status	predicted
Creation Date	2024-02-20 23:40:53 UTC
Update Date	2025-03-21 17:58:53 UTC
HMDB ID	HMDB0130406
Metabolite Identification
DeepMet ID	DMID00017317
Name	2-(3,5-dihydroxyphenyl)-3,5,7-trihydroxy-1λ⁴-chromen-1-ylium
Frequency	244.1
Structure
Chemical Formula	C₁₅H₁₁O₆+
Molecular Mass	287.055
SMILES	Oc1cc(O)cc(-c2[o+]c3cc(O)cc(O)c3cc2O)c1
InChI Key	VBOKBVZZEYWRLT-UHFFFAOYSA-O
Chemical Taxonomy
Kingdom	organic compounds
Superclass	phenylpropanoids and polyketides
Class	flavonoids
Subclass	hydroxyflavonoids
Direct Parent	3-hydroxyflavonoids
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	1-benzopyrans 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 3'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids anthocyanidins benzene and substituted derivatives heteroaromatic compounds hydrocarbon derivatives organic cations organooxygen compounds oxacyclic compounds resorcinols
Substituents	3-hydroxyflavonoid monocyclic benzene moiety benzopyran 1-benzopyran heteroaromatic compound 5-hydroxyflavonoid 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 3'-hydroxyflavonoid resorcinol oxacycle organic oxygen compound aromatic heteropolycyclic compound 7-hydroxyflavonoid anthocyanidin phenol hydrocarbon derivative benzenoid organic cation organoheterocyclic compound organooxygen compound

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