DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:15:43 UTC
Update Date	2025-03-25 00:59:27 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02237214
Frequency	0.5
Structure
Chemical Formula	C₁₄H₂₀NO₁₀P
Molecular Mass	393.0825
SMILES	O=C(O)C(Cc1ccccc1)NC(=O)C(O)C(O)C(O)COP(=O)(O)O
InChI Key	LEDMZQOQLHMQPM-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	phenylalanine and derivatives
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	alpha amino acids amphetamines and derivatives benzene and substituted derivatives carbonyl compounds carboxylic acids hydrocarbon derivatives monoalkyl phosphates monocarboxylic acids and derivatives monosaccharides n-acyl amines n-acyl-alpha amino acids organic oxides organonitrogen compounds organopnictogen compounds pentose phosphates phenylpropanoic acids secondary alcohols secondary carboxylic acid amides
Substituents	fatty acyl monocyclic benzene moiety carbonyl group carboxylic acid 3-phenylpropanoic-acid pentose phosphate fatty amide monosaccharide saccharide organic oxide organonitrogen compound alpha-amino acid organopnictogen compound amphetamine or derivatives n-acyl-alpha amino acid or derivatives alcohol n-acyl-alpha-amino acid carboxamide group n-acyl-amine aromatic homomonocyclic compound secondary carboxylic acid amide monocarboxylic acid or derivatives phenylalanine or derivatives organic oxygen compound phosphoric acid ester monoalkyl phosphate secondary alcohol hydrocarbon derivative benzenoid organic nitrogen compound organic phosphoric acid derivative alkyl phosphate organooxygen compound

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