DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:26:21 UTC
Update Date	2025-03-21 18:39:24 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00125475
Frequency	20.4
Structure
Chemical Formula	C₁₅H₁₉NO₁₀
Molecular Mass	373.1009
SMILES	O=C(O)C1OC(N(O)C(Cc2ccc(O)cc2)C(=O)O)C(O)C(O)C1O
InChI Key	FGOPMOMCHMHFQF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	carboxylic acids and derivatives
Subclass	amino acids, peptides, and analogues
Direct Parent	tyrosine and derivatives
Geometric Descriptor	aromatic heteromonocyclic compounds
Alternative Parents	1-hydroxy-2-unsubstituted benzenoids alpha amino acids amphetamines and derivatives benzene and substituted derivatives beta hydroxy acids and derivatives carbonyl compounds carboxylic acids dicarboxylic acids and derivatives glucuronic acid derivatives hydrocarbon derivatives monosaccharides n-glucuronides n-organohydroxylamines organic oxides organopnictogen compounds oxacyclic compounds oxanes phenylalanine and derivatives phenylpropanoic acids pyran carboxylic acids secondary alcohols
Substituents	monocyclic benzene moiety carbonyl group carboxylic acid glucuronic acid or derivatives aromatic heteromonocyclic compound 3-phenylpropanoic-acid 1-hydroxy-2-unsubstituted benzenoid monosaccharide pyran carboxylic acid n-glucuronide beta-hydroxy acid saccharide organic oxide organonitrogen compound alpha-amino acid organopnictogen compound oxane organoheterocyclic compound amphetamine or derivatives alcohol pyran carboxylic acid or derivatives tyrosine or derivatives hydroxy acid n-organohydroxylamine oxacycle phenylalanine or derivatives organic oxygen compound pyran secondary alcohol dicarboxylic acid or derivatives phenol hydrocarbon derivative benzenoid organic nitrogen compound organooxygen compound

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