DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:18:24 UTC
Update Date	2025-03-25 01:00:33 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02243328
Frequency	0.5
Structure
Chemical Formula	C₁₄H₂₆N₂O₇
Molecular Mass	334.174
SMILES	CC(=O)NC1C(O)OC(CO)C(O)C1NC(CC(C)C)C(=O)O
InChI Key	MWMDNVIDNUNVSC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	lipids and lipid-like molecules
Class	saccharolipids
Subclass	saccharolipids
Direct Parent	saccharolipids
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	acetamides acylaminosugars alpha amino acids amino acids aminosaccharides carbonyl compounds carboxylic acids dialkylamines hemiacetals heterocyclic fatty acids hydrocarbon derivatives hydroxy fatty acids leucine and derivatives methyl-branched fatty acids monocarboxylic acids and derivatives monosaccharides organic oxides organopnictogen compounds oxacyclic compounds oxanes primary alcohols secondary alcohols secondary carboxylic acid amides short-chain hydroxy acids and derivatives
Substituents	fatty acyl carbonyl group carboxylic acid short-chain hydroxy acid amino acid or derivatives amino acid heterocyclic fatty acid monosaccharide fatty acid alpha-amino acid or derivatives carboxylic acid derivative saccharide organic oxide leucine or derivatives aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound hemiacetal hydroxy fatty acid oxane primary alcohol organoheterocyclic compound acetamide alcohol amino saccharide secondary aliphatic amine methyl-branched fatty acid secondary amine carboxamide group branched fatty acid acylaminosugar oxacycle secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound secondary alcohol hydrocarbon derivative organic nitrogen compound saccharolipid organooxygen compound amine

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