DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 13:44:29 UTC
Update Date	2025-03-24 22:12:10 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02025292
Frequency	0.6
Structure
Chemical Formula	C₅₁H₉₈N₂O₁₆P+
Molecular Mass	1025.6648
SMILES	CCCCCCC=CCCCCCCCC(=O)NC(COP(=O)(OCC[N+](C)(C)C)OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O)C(O)C=CCCCCCCCCCCCCC
InChI Key	FVXKDXBNFUAMOO-UHFFFAOYSA-O
Chemical Taxonomy
Kingdom	organic compounds
Superclass	lipids and lipid-like molecules
Class	glycerophospholipids
Subclass	phosphoglycosphingolipids
Direct Parent	phosphoglycosphingolipids
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	acetals alkyl glycosides amines carbonyl compounds carboxylic acids and derivatives fatty acyl glycosides of mono- and disaccharides hydrocarbon derivatives monosaccharides n-acyl amines organic cations organic oxides organic salts organopnictogen compounds oxacyclic compounds oxanes phosphocholines phosphoethanolamines phosphosphingolipids primary alcohols secondary alcohols secondary carboxylic acid amides tetraalkylammonium salts trialkyl phosphates
Substituents	fatty acyl fatty acyl glycoside of mono- or disaccharide carbonyl group trialkyl phosphate fatty amide monosaccharide carboxylic acid derivative phosphoglycosphingolipid backbone phosphoethanolamine saccharide organic oxide acetal aliphatic heteromonocyclic compound organonitrogen compound organopnictogen compound organic cation oxane organic salt primary alcohol organoheterocyclic compound alcohol fatty acyl glycoside tetraalkylammonium salt quaternary ammonium salt carboxamide group n-acyl-amine phosphocholine oxacycle secondary carboxylic acid amide organic oxygen compound phosphoric acid ester secondary alcohol hydrocarbon derivative sphingoid-1-phosphate or derivatives organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate organooxygen compound alkyl glycoside

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