DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:43:57 UTC
Update Date	2025-03-25 00:47:52 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02164600
Frequency	0.5
Structure
Chemical Formula	C₁₇H₂₁NO₅
Molecular Mass	319.142
SMILES	CC(c1ccc(O)cc1)c1cccn1C1OC(CO)C(O)C1O
InChI Key	ZUOZGNRVCLHWJW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	benzenoids
Class	phenols
Subclass	1-hydroxy-2-unsubstituted benzenoids
Direct Parent	1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor	aromatic heteromonocyclic compounds
Alternative Parents	azacyclic compounds benzene and substituted derivatives heteroaromatic compounds hydrocarbon derivatives monosaccharides organonitrogen compounds organopnictogen compounds oxacyclic compounds primary alcohols secondary alcohols substituted pyrroles tetrahydrofurans
Substituents	alcohol monocyclic benzene moiety aromatic heteromonocyclic compound azacycle tetrahydrofuran heteroaromatic compound 1-hydroxy-2-unsubstituted benzenoid monosaccharide substituted pyrrole oxacycle saccharide organic oxygen compound pyrrole organonitrogen compound secondary alcohol organopnictogen compound hydrocarbon derivative organic nitrogen compound primary alcohol organoheterocyclic compound organooxygen compound

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