DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:54:09 UTC
Update Date	2025-03-21 18:04:06 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00048509
Frequency	68.3
Structure
Chemical Formula	C₁₅H₂₉N₃O₈
Molecular Mass	379.1955
SMILES	CC(=O)NC1C(O)C(O)C(CO)OC1(O)CNCCCCC(N)C(=O)O
InChI Key	DVEONWWRSLARKC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic oxygen compounds
Class	organooxygen compounds
Subclass	carbohydrates and carbohydrate conjugates
Direct Parent	acylaminosugars
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	acetamides alpha amino acids amino acids amino fatty acids carbonyl compounds carboxylic acids dialkylamines hemiacetals heterocyclic fatty acids hydrocarbon derivatives hydroxy fatty acids medium-chain fatty acids medium-chain hydroxy acids and derivatives monoalkylamines monocarboxylic acids and derivatives monosaccharides n-acyl-alpha-hexosamines organic oxides organopnictogen compounds oxacyclic compounds oxanes primary alcohols saccharolipids secondary alcohols secondary carboxylic acid amides
Substituents	fatty acyl carbonyl group carboxylic acid amino acid or derivatives amino acid heterocyclic fatty acid monosaccharide fatty acid alpha-amino acid or derivatives carboxylic acid derivative medium-chain hydroxy acid n-acyl-alpha-hexosamine organic oxide aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound hemiacetal medium-chain fatty acid hydroxy fatty acid oxane primary alcohol organoheterocyclic compound acetamide alcohol secondary aliphatic amine secondary amine carboxamide group amino fatty acid acylaminosugar oxacycle secondary carboxylic acid amide monocarboxylic acid or derivatives secondary alcohol hydrocarbon derivative primary aliphatic amine organic nitrogen compound saccharolipid amine

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