DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:22:26 UTC
Update Date	2025-03-25 01:01:56 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02252652
Frequency	0.5
Structure
Chemical Formula	C₉H₁₅N₂O₉P
Molecular Mass	326.0515
SMILES	NC(CC(=O)O)C(=O)N1CC(OP(=O)(O)O)CC1C(=O)O
InChI Key	SGPJLCAKLIXSNR-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	dipeptides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids azacyclic compounds carbonyl compounds carboxylic acids dicarboxylic acids and derivatives fatty acids and conjugates hydrocarbon derivatives monoalkyl phosphates monoalkylamines n-acyl-alpha amino acids n-acylpyrrolidines organic oxides organonitrogen compounds organopnictogen compounds proline and derivatives pyrrolidine carboxylic acids short-chain hydroxy acids and derivatives tertiary carboxylic acid amides
Substituents	carbonyl group carboxylic acid short-chain hydroxy acid n-acylpyrrolidine fatty acid alpha-amino acid or derivatives organic oxide pyrrolidine carboxylic acid tertiary carboxylic acid amide aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound pyrrolidine organoheterocyclic compound n-acyl-alpha amino acid or derivatives proline or derivatives alpha-amino acid amide azacycle n-acyl-alpha-amino acid carboxamide group alpha-dipeptide pyrrolidine carboxylic acid or derivatives organic oxygen compound phosphoric acid ester monoalkyl phosphate dicarboxylic acid or derivatives hydrocarbon derivative primary aliphatic amine organic nitrogen compound organic phosphoric acid derivative alkyl phosphate organooxygen compound

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