DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:53:03 UTC
Update Date	2025-03-25 00:51:12 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02185437
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₅N₂O₅P
Molecular Mass	274.0719
SMILES	NC(=O)CC(N)Cc1ccc(OP(=O)(O)O)cc1
InChI Key	PWADAEGSFRLYJG-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	beta amino acids and derivatives
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	amphetamines and derivatives carbonyl compounds carboxylic acids and derivatives fatty amides hydrocarbon derivatives monoalkylamines organic oxides organonitrogen compounds organopnictogen compounds phenoxy compounds phenyl phosphates primary carboxylic acid amides
Substituents	primary carboxylic acid amide fatty acyl monocyclic benzene moiety carbonyl group fatty amide organic oxide organonitrogen compound organopnictogen compound amphetamine or derivatives phenyl phosphate carboxamide group beta amino acid or derivatives aromatic homomonocyclic compound organic oxygen compound phosphoric acid ester hydrocarbon derivative aryl phosphomonoester benzenoid primary aliphatic amine organic nitrogen compound phenoxy compound aryl phosphate organic phosphoric acid derivative organooxygen compound

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