DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:01:35 UTC
Update Date	2025-03-25 00:54:13 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02204881
Frequency	0.5
Structure
Chemical Formula	C₂₀H₁₉O₁₄P
Molecular Mass	514.0512
SMILES	O=c1c(OC2OC(COP(=O)(O)O)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
InChI Key	USYHWEWXTNMZER-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	phenylpropanoids and polyketides
Class	flavonoids
Subclass	flavonoid glycosides
Direct Parent	flavonoid-3-o-glycosides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	1,2-diols 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 3'-hydroxyflavonoids 4'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids acetals benzene and substituted derivatives chromones flavonoids heteroaromatic compounds hydrocarbon derivatives monoalkyl phosphates monosaccharides organic oxides oxacyclic compounds pentose phosphates pyranones and derivatives secondary alcohols tetrahydrofurans vinylogous acids
Substituents	monocyclic benzene moiety 1-benzopyran pentose phosphate 1-hydroxy-2-unsubstituted benzenoid monosaccharide pentose-5-phosphate saccharide organic oxide acetal chromone aromatic heteropolycyclic compound flavonoid-3-o-glycoside pyranone organoheterocyclic compound 1,2-diol alcohol benzopyran tetrahydrofuran heteroaromatic compound 5-hydroxyflavonoid 1-hydroxy-4-unsubstituted benzenoid 3'-hydroxyflavonoid oxacycle vinylogous acid organic oxygen compound phosphoric acid ester pyran monoalkyl phosphate 7-hydroxyflavonoid secondary alcohol 4'-hydroxyflavonoid phenol hydrocarbon derivative benzenoid organic phosphoric acid derivative alkyl phosphate organooxygen compound

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