DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:07:54 UTC
Update Date	2025-03-25 00:56:37 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02219609
Frequency	0.5
Structure
Chemical Formula	C₁₄H₁₈O₁₀
Molecular Mass	346.09
SMILES	COc1cc(C(=O)OCC2OC(O)C(O)C(O)C2O)c(O)cc1O
InChI Key	ABGCFONOCBFPNC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	phenylpropanoids and polyketides
Class	tannins
Subclass	hydrolyzable tannins
Direct Parent	hydrolyzable tannins
Geometric Descriptor	aromatic heteromonocyclic compounds
Alternative Parents	1-hydroxy-2-unsubstituted benzenoids 4-alkoxyphenols alkyl aryl ethers anisoles benzoyl derivatives carboxylic acid esters hemiacetals hydrocarbon derivatives m-methoxybenzoic acids and derivatives methoxybenzenes methoxyphenols monocarboxylic acids and derivatives monosaccharides organic oxides oxacyclic compounds oxanes phenoxy compounds resorcinols salicylic acid and derivatives secondary alcohols vinylogous acids o-hydroxybenzoic acid esters p-hydroxybenzoic acid alkyl esters
Substituents	phenol ether monocyclic benzene moiety ether aromatic heteromonocyclic compound p-hydroxybenzoic acid ester benzoyl methoxyphenol 1-hydroxy-2-unsubstituted benzenoid monosaccharide benzoate ester alkyl aryl ether carboxylic acid derivative resorcinol saccharide organic oxide hemiacetal m-methoxybenzoic acid or derivatives oxane organoheterocyclic compound hydrolyzable tannin alcohol 4-alkoxyphenol benzoic acid or derivatives methoxybenzene p-hydroxybenzoic acid alkyl ester oxacycle vinylogous acid monocarboxylic acid or derivatives organic oxygen compound salicylic acid or derivatives o-hydroxybenzoic acid ester anisole carboxylic acid ester secondary alcohol phenol hydrocarbon derivative benzenoid phenoxy compound organooxygen compound

Showing information for DMID02219609