Compound Identification
SMILES
COC(=O)CC1(O)C2C(OC3=C(O)C=C(O)C=C3O)=CC(=O)C1(O)CC(=O)C2(O)C(=O)OC
InChIKey
InChIKey=NVERXAOGYZDKLX-UHFFFAOYSA-N
Formula
C20H20O13
Mass
468.367
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenols
-
Subclass
Benzenetriols and derivatives
- Level 5 Phloroglucinols and derivatives
-
Subclass
Benzenetriols and derivatives
-
Class
Phenols
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenols
Subclass
Benzenetriols and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phloroglucinols and derivatives
Alternative Parents
Phenoxy compounds Cyclohexenones 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Dicarboxylic acids and derivatives Acyloins Vinylogous esters Tertiary alcohols Methyl esters Cyclic alcohols and derivatives Polyols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Phloroglucinol derivative - Phenoxy compound - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Cyclohexenone - Acyloin - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Cyclic alcohol - Vinylogous ester - Methyl ester - Tertiary alcohol - Carboxylic acid ester - Cyclic ketone - Ketone - Carboxylic acid derivative - Polyol - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as phloroglucinols and derivatives. These are compounds containing a phloroglucinol (benzene-1,3,5-triol) moiety, which consists of a benzene ring bearing one hydroxyl group at positions 1,3, and 5.
External Descriptors
Not available