DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:01:04 UTC
Update Date	2025-03-25 00:54:02 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02203701
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₇NO₇
Molecular Mass	263.1005
SMILES	O=C(O)CCC(O)C(CCC(=O)O)NCC(=O)O
InChI Key	OYOLGSZKKMUPTL-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	alpha amino acids amino acids carbonyl compounds carboxylic acids dialkylamines hydrocarbon derivatives organic oxides organopnictogen compounds secondary alcohols tricarboxylic acids and derivatives
Substituents	alcohol aliphatic acyclic compound secondary aliphatic amine carbonyl group carboxylic acid amino acid gamma amino acid or derivatives tricarboxylic acid or derivatives alpha-amino acid or derivatives secondary amine organic oxide organic oxygen compound organonitrogen compound alpha-amino acid secondary alcohol organopnictogen compound hydrocarbon derivative organic nitrogen compound organooxygen compound amine

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