DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:54:28 UTC
Update Date	2025-03-25 00:51:42 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02188704
Frequency	0.5
Structure
Chemical Formula	C₁₂H₂₁O₁₅P
Molecular Mass	436.0618
SMILES	CC(OC1C(O)C(O)C(C(O)C(O)COP(=O)(O)O)OC1(O)C(=O)O)C(=O)O
InChI Key	YUMNXIWBECTDQZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic oxygen compounds
Class	organooxygen compounds
Subclass	carbohydrates and carbohydrate conjugates
Direct Parent	c-glucuronides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	alpha hydroxy acids and derivatives carbonyl compounds carboxylic acids dialkyl ethers dicarboxylic acids and derivatives glucuronic acid derivatives hemiacetals hydrocarbon derivatives monoalkyl phosphates monosaccharides organic oxides oxacyclic compounds oxanes pyran carboxylic acids secondary alcohols
Substituents	carbonyl group ether carboxylic acid alpha-hydroxy acid monosaccharide carboxylic acid derivative pyran carboxylic acid dialkyl ether organic oxide aliphatic heteromonocyclic compound hemiacetal oxane organoheterocyclic compound c-glucuronide alcohol pyran carboxylic acid or derivatives hydroxy acid oxacycle phosphoric acid ester pyran monoalkyl phosphate secondary alcohol dicarboxylic acid or derivatives hydrocarbon derivative organic phosphoric acid derivative alkyl phosphate

Showing information for DMID02188704