DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:47:19 UTC
Update Date	2025-03-25 01:11:04 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02309569
Frequency	0.5
Structure
Chemical Formula	C₁₂₀H₂₂₇N₃O₂₆P₂
Molecular Mass	2188.6008
SMILES	CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)OC1C(OP(=O)(O)O)CC(NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)C(OCC2OC(OP(=O)(O)O)C(NC(=O)CC(O)CCCCCCCCCCC)C(OC(=O)CC(O)CCCCCCCCCCC)C2O)C1NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCC
InChI Key	LKUDQHPKCIVFSC-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	beta hydroxy acids and derivatives carbonyl compounds carboxylic acid esters cyclitols and derivatives dialkyl ethers fatty acid esters hydrocarbon derivatives monoalkyl phosphates monosaccharides n-acyl amines n-acyl-alpha-hexosamines organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds oxanes pentacarboxylic acids and derivatives saccharolipids secondary alcohols secondary carboxylic acid amides
Substituents	fatty acyl carbonyl group ether fatty amide monosaccharide carboxylic acid derivative dialkyl ether n-acyl-alpha-hexosamine beta-hydroxy acid organic oxide aliphatic heteromonocyclic compound organonitrogen compound organopnictogen compound oxane organoheterocyclic compound alcohol cyclitol or derivatives hydroxy acid carboxamide group pentacarboxylic acid or derivatives n-acyl-amine acylaminosugar oxacycle secondary carboxylic acid amide fatty acid ester phosphoric acid ester monoalkyl phosphate carboxylic acid ester secondary alcohol hydrocarbon derivative organic nitrogen compound saccharolipid organic phosphoric acid derivative alkyl phosphate

Showing information for DMID02309569