DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:14:41 UTC
Update Date	2025-03-25 00:37:30 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02096931
Frequency	0.6
Structure
Chemical Formula	C₄₀H₇₇NO₂₀P₂
Molecular Mass	953.4514
SMILES	CCCCCCCCCCCC(O)CC(=O)NC1C(OP(=O)(O)O)OC(COCC(=O)C(O)C(O)C(O)COP(=O)(O)O)C(O)C1OC(=O)CC(O)CCCCCCCCCCC
InChI Key	WUZKPYHOLZLEQN-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	acyloins alpha-hydroxy ketones beta hydroxy acids and derivatives beta-hydroxy ketones carboxylic acid esters dialkyl ethers fatty acid esters hexose phosphates hydrocarbon derivatives monoalkyl phosphates monocarboxylic acids and derivatives monosaccharides n-acyl amines n-acyl-alpha-hexosamines organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds oxanes saccharolipids secondary alcohols secondary carboxylic acid amides
Substituents	fatty acyl beta-hydroxy ketone carbonyl group ether fatty amide monosaccharide alpha-hydroxy ketone carboxylic acid derivative dialkyl ether n-acyl-alpha-hexosamine ketone beta-hydroxy acid organic oxide aliphatic heteromonocyclic compound organonitrogen compound organopnictogen compound oxane organoheterocyclic compound alcohol hydroxy acid carboxamide group n-acyl-amine acylaminosugar oxacycle secondary carboxylic acid amide fatty acid ester monocarboxylic acid or derivatives phosphoric acid ester monoalkyl phosphate acyloin carboxylic acid ester secondary alcohol hexose phosphate hydrocarbon derivative organic nitrogen compound saccharolipid organic phosphoric acid derivative alkyl phosphate

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