DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:00:32 UTC
Update Date	2025-03-25 00:53:51 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02202445
Frequency	0.5
Structure
Chemical Formula	C₁₁H₁₇NO₆P+
Molecular Mass	290.0788
SMILES	C[N+](C)(C(Cc1ccc(O)cc1)C(=O)O)P(=O)(O)O
InChI Key	KVUZDZBBZZFJNR-UHFFFAOYSA-O
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 homomonocyclic compounds
Alternative Parents	1-hydroxy-2-unsubstituted benzenoids alpha amino acids amphetamines and derivatives benzene and substituted derivatives carbonyl compounds carboxylic acids hydrocarbon derivatives monocarboxylic acids and derivatives organic cations organic oxides organic phosphoric acids and derivatives organonitrogen compounds organopnictogen compounds phenylalanine and derivatives phenylpropanoic acids
Substituents	monocyclic benzene moiety carbonyl group carboxylic acid 3-phenylpropanoic-acid 1-hydroxy-2-unsubstituted benzenoid organic oxide organonitrogen compound alpha-amino acid organopnictogen compound organic cation amphetamine or derivatives tyrosine or derivatives aromatic homomonocyclic compound monocarboxylic acid or derivatives phenylalanine or derivatives organic oxygen compound phenol hydrocarbon derivative benzenoid organic nitrogen compound organic phosphoric acid derivative organooxygen compound

Showing information for DMID02202445