DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 07:38:57 UTC
Update Date	2025-03-24 22:18:23 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID01151302
Frequency	1.2
Structure
Chemical Formula	C₅₄H₁₀₁NO₂₁P₂
Molecular Mass	1161.6341
SMILES	CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)OC1C(NC(=O)CC(O)CCCCCCCCCCC)C(OP(=O)(O)O)OC(COC2CC(O)C(O)C(C(=O)O)O2)C1OP(=O)(O)O
InChI Key	UDAIPUKWFJTXOX-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	acetals beta hydroxy acids and derivatives carbonyl compounds carboxylic acid esters carboxylic acids fatty acid esters hexose phosphates hydrocarbon derivatives monoalkyl phosphates monosaccharides n-acyl amines n-acyl-alpha-hexosamines organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds oxanes pyran carboxylic acids saccharolipids secondary alcohols secondary carboxylic acid amides tricarboxylic acids and derivatives
Substituents	fatty acyl carbonyl group carboxylic acid fatty amide monosaccharide tricarboxylic acid or derivatives carboxylic acid derivative pyran carboxylic acid n-acyl-alpha-hexosamine beta-hydroxy acid organic oxide acetal aliphatic heteromonocyclic compound organonitrogen compound organopnictogen compound oxane organoheterocyclic compound alcohol pyran carboxylic acid or derivatives hydroxy acid carboxamide group n-acyl-amine acylaminosugar oxacycle secondary carboxylic acid amide fatty acid ester phosphoric acid ester pyran monoalkyl phosphate carboxylic acid ester hexose phosphate secondary alcohol hydrocarbon derivative organic nitrogen compound saccharolipid organic phosphoric acid derivative alkyl phosphate

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