DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:04:48 UTC
Update Date	2025-03-25 00:55:28 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02212492
Frequency	0.5
Structure
Chemical Formula	C₂₁H₄₂NO₇P
Molecular Mass	451.2699
SMILES	CCCCCCCCCCCCCCCC(=O)NC(CCC(=O)O)COP(=O)(O)O
InChI Key	ZHLQNLFTIFGCCP-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	gamma amino acids and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	carbonyl compounds carboxylic acids fatty acids and conjugates hydrocarbon derivatives monoalkyl phosphates monocarboxylic acids and derivatives n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds phosphoethanolamines secondary carboxylic acid amides short-chain hydroxy acids and derivatives
Substituents	fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid short-chain hydroxy acid gamma amino acid or derivatives fatty amide fatty acid phosphoethanolamine organic oxide organonitrogen compound organopnictogen compound carboxamide group n-acyl-amine secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound phosphoric acid ester monoalkyl phosphate hydrocarbon derivative organic nitrogen compound organic phosphoric acid derivative alkyl phosphate organooxygen compound

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