DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:16:12 UTC
Update Date	2025-03-21 18:34:29 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00101001
Frequency	37.8
Structure
Chemical Formula	C₁₃H₂₂N₂O₉
Molecular Mass	350.1325
SMILES	CC(O)=NC1C(O)OC(CO)C(O)C1OC(=O)CCC(N)C(=O)O
InChI Key	FYQBSIYREVFOTK-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	alpha amino acids carbonyl compounds carboximidic acids carboxylic acid esters carboxylic acids dicarboxylic acids and derivatives fatty acid esters glutamic acid and derivatives hemiacetals heterocyclic fatty acids hydrocarbon derivatives hydroxy fatty acids monoalkylamines monosaccharides n-acyl-alpha-hexosamines organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds oxanes primary alcohols propargyl-type 1,3-dipolar organic compounds saccharolipids secondary alcohols short-chain hydroxy acids and derivatives
Substituents	fatty acyl carboximidic acid carbonyl group carboxylic acid short-chain hydroxy acid heterocyclic fatty acid monosaccharide alpha-amino acid or derivatives carboxylic acid derivative n-acyl-alpha-hexosamine propargyl-type 1,3-dipolar organic compound organic oxide aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound hemiacetal hydroxy fatty acid oxane primary alcohol organoheterocyclic compound alcohol organic 1,3-dipolar compound glutamic acid or derivatives acylaminosugar oxacycle fatty acid ester carboxylic acid ester secondary alcohol dicarboxylic acid or derivatives hydrocarbon derivative primary aliphatic amine organic nitrogen compound saccharolipid

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