Structure Information
Structure

Compound Identification

SMILES

O[C@@H]1[C@H]([C@H](OC2=C1C=CC(O)=C2)C1=CC=C(OCCN2CCCCC2)C=C1)C1=CC=C(O)C=C1

InChIKey

InChIKey=FKPQJDFSZNBBPP-OZNIXHKMSA-N

Formula

C28H31NO5

Mass

461.558

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

Flavans

Intermediate Tree Nodes

Not available

Direct Parent

Flavan-4-ols

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-hydroxyflavonoid - 7-hydroxyflavonoid - Hydroxyisoflavonoid - Flavan-4-ol - Hydroxyflavonoid - Isoflavonoid skeleton - Isoflavonoid - Isoflavan - Stilbene - Chromane - Benzopyran - 1-benzopyran - Phenoxy compound - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Piperidine - Tertiary aliphatic amine - Secondary alcohol - Tertiary amine - Oxacycle - Azacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Alcohol - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavan-4-ols. These are flavans that bear and hydroxyl group at position 4 (B ring), but not at the 3-position.

External Descriptors

Not available

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