DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:38:53 UTC
Update Date	2025-03-25 00:46:05 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02153221
Frequency	0.5
Structure
Chemical Formula	C₇H₁₆N₃O₅P
Molecular Mass	253.0828
SMILES	NC(=O)CCC(N)C(=O)NCCP(=O)(O)O
InChI Key	MLNFLYOSIDOKSI-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	glutamine and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids carbonyl compounds carboxylic acids and derivatives hydrocarbon derivatives monoalkylamines n-acyl amines organic oxides organic phosphonic acids and derivatives organonitrogen compounds organophosphorus compounds organopnictogen compounds primary carboxylic acid amides secondary carboxylic acid amides
Substituents	primary carboxylic acid amide fatty acyl aliphatic acyclic compound carbonyl group glutamine or derivatives alpha-amino acid amide fatty amide carboxamide group n-acyl-amine secondary carboxylic acid amide organic oxide organic oxygen compound organonitrogen compound alpha-amino acid organopnictogen compound organophosphorus compound hydrocarbon derivative primary aliphatic amine organic nitrogen compound organophosphonic acid derivative organooxygen compound

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