DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:38:18 UTC
Update Date	2025-03-21 17:58:00 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00011539
Frequency	399.8
Structure
Chemical Formula	C₆H₁₀O₄
Molecular Mass	146.0579
SMILES	CC(=O)CCC(O)C(=O)O
InChI Key	ZTKZAEPGGBIAAW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	hydroxy acids and derivatives
Subclass	medium-chain hydroxy acids and derivatives
Direct Parent	medium-chain hydroxy acids and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alpha hydroxy acids and derivatives carboxylic acids hydrocarbon derivatives hydroxy fatty acids ketones medium-chain fatty acids monocarboxylic acids and derivatives monosaccharides organic oxides secondary alcohols
Substituents	alcohol fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid alpha-hydroxy acid monosaccharide fatty acid carboxylic acid derivative medium-chain hydroxy acid ketone saccharide organic oxide monocarboxylic acid or derivatives organic oxygen compound secondary alcohol hydrocarbon derivative medium-chain fatty acid hydroxy fatty acid organooxygen compound

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