Compound Identification
SMILES
COC1=CC(=CC(OC)=C1O)C1OC2=CC(O)=CC(O)=C2C(=O)C1O
InChIKey
InChIKey=OGGVSBOPKJAJQA-UHFFFAOYSA-N
Formula
C17H16O8
Mass
348.307
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
Flavans
-
Level 5
Flavan-3-ols
-
Level 6
Catechins
- Level 7 Epigallocatechins
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Level 6
Catechins
-
Level 5
Flavan-3-ols
-
Subclass
Flavans
-
Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavans
Intermediate Tree Nodes
Flavan-3-ols - Catechins
Direct Parent
Epigallocatechins
Alternative Parents
3'-O-methylated flavonoids 3-hydroxyflavonoids 4'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Flavanonols Chromones Dimethoxybenzenes Methoxyphenols Aryl alkyl ketones Anisoles Phenoxy compounds 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids Vinylogous acids Secondary alcohols Oxacyclic compounds Polyols Hydrocarbon derivatives Organic oxides Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Epigallocatechin - 3p-methoxyflavonoid-skeleton - Flavanone - 3-hydroxyflavonoid - 4'-hydroxyflavonoid - 5-hydroxyflavonoid - Flavanonol - Hydroxyflavonoid - 7-hydroxyflavonoid - Chromone - Chromane - Benzopyran - M-dimethoxybenzene - Methoxyphenol - 1-benzopyran - Dimethoxybenzene - Phenol ether - Anisole - Phenoxy compound - Methoxybenzene - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Phenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Secondary alcohol - Ketone - Oxacycle - Organoheterocyclic compound - Polyol - Ether - Aldehyde - Alcohol - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as epigallocatechins. These are compounds containing epigallocatechin or a derivative. Epigallocatechin is a flavan-3-ol containing a benzopyran-3,5,7-triol linked to a 3,4,5-hydroxyphenyl moiety.
External Descriptors
Not available