DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:10:48 UTC
Update Date	2025-03-25 00:57:39 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02226190
Frequency	0.5
Structure
Chemical Formula	C₁₃H₂₉N₃O₈P+
Molecular Mass	386.1687
SMILES	CC(O)(COP(=O)(O)OCC[N+](C)(C)C)C(N)C(=O)NCCC(=O)O
InChI Key	PROBGMIGYRRVIT-UHFFFAOYSA-O
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	peptidomimetics
Subclass	hybrid peptides
Direct Parent	hybrid peptides
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids amines beta amino acids and derivatives carbonyl compounds carboxylic acids dialkyl phosphates hydrocarbon derivatives monoalkylamines monocarboxylic acids and derivatives n-acyl amines organic cations organic oxides organic salts organopnictogen compounds phosphocholines secondary carboxylic acid amides tertiary alcohols tetraalkylammonium salts
Substituents	fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid fatty amide alpha-amino acid or derivatives carboxylic acid derivative organic oxide organonitrogen compound alpha-amino acid organopnictogen compound organic cation organic salt alcohol alpha-amino acid amide tetraalkylammonium salt quaternary ammonium salt carboxamide group n-acyl-amine beta amino acid or derivatives phosphocholine secondary carboxylic acid amide dialkyl phosphate tertiary alcohol monocarboxylic acid or derivatives organic oxygen compound phosphoric acid ester hybrid peptide hydrocarbon derivative primary aliphatic amine organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate organooxygen compound

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