DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 11:59:46 UTC
Update Date	2025-03-24 21:26:06 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID01776946
Frequency	0.7
Structure
Chemical Formula	C₃₇H₆₄NO₃₄P
Molecular Mass	1097.3047
SMILES	NCCOP(=O)(O)OC1CC(OC2CC(OCC3OC(OC4C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C4O)OC(C(O)CO)C3O)(C(=O)O)OC(C(O)CO)C2O)(C(=O)O)OC(C(O)CO)C1O
InChI Key	GKUMKEAIAVHMNA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	lipids and lipid-like molecules
Class	fatty acyls
Subclass	fatty acyl glycosides
Direct Parent	fatty acyl glycosides of mono- and disaccharides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	1,3-dioxanes alkyl glycosides alpha-hydroxyaldehydes beta-hydroxy aldehydes c-glucuronides carboxylic acid orthoesters carboxylic acids dialkyl phosphates dicarboxylic acids and derivatives hydrocarbon derivatives ketals monoalkylamines monosaccharides organic oxides organonitrogen compounds organopnictogen compounds ortho esters oxacyclic compounds oxanes phosphoethanolamines primary alcohols pyran carboxylic acids secondary alcohols
Substituents	fatty acyl glycoside of mono- or disaccharide beta-hydroxy aldehyde carbonyl group carboxylic acid ortho ester monosaccharide carboxylic acid orthoester carboxylic acid derivative pyran carboxylic acid phosphoethanolamine saccharide organic oxide alpha-hydroxyaldehyde acetal ketal aliphatic heteromonocyclic compound organonitrogen compound organopnictogen compound orthocarboxylic acid derivative oxane primary alcohol organoheterocyclic compound c-glucuronide alcohol pyran carboxylic acid or derivatives aldehyde oxacycle dialkyl phosphate organic oxygen compound phosphoric acid ester pyran secondary alcohol dicarboxylic acid or derivatives hydrocarbon derivative primary aliphatic amine organic nitrogen compound organic phosphoric acid derivative meta-dioxane alkyl phosphate organooxygen compound alkyl glycoside

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