DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:50:02 UTC
Update Date	2025-03-25 00:50:05 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02178615
Frequency	0.5
Structure
Chemical Formula	C₁₈H₂₆O₁₀
Molecular Mass	402.1526
SMILES	COC1OC(CO)C(O)C(O)C1OC(=O)CCC(O)Cc1ccc(O)c(O)c1
InChI Key	AWHJNLCTWIKBRU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	lipids and lipid-like molecules
Class	saccharolipids
Subclass	saccharolipids
Direct Parent	saccharolipids
Geometric Descriptor	aromatic heteromonocyclic compounds
Alternative Parents	1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids acetals benzene and substituted derivatives carbonyl compounds carboxylic acid esters fatty acid esters hydrocarbon derivatives monocarboxylic acids and derivatives monosaccharides organic oxides oxacyclic compounds oxanes primary alcohols secondary alcohols
Substituents	fatty acyl monocyclic benzene moiety carbonyl group aromatic heteromonocyclic compound 1-hydroxy-2-unsubstituted benzenoid monosaccharide carboxylic acid derivative saccharide organic oxide acetal oxane primary alcohol organoheterocyclic compound alcohol 1-hydroxy-4-unsubstituted benzenoid oxacycle fatty acid ester monocarboxylic acid or derivatives organic oxygen compound carboxylic acid ester secondary alcohol phenol hydrocarbon derivative benzenoid saccharolipid organooxygen compound

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