Compound Identification
SMILES
O[C@@H]1C[C@H](OC2=C1C=CC1=CC=CC=C21)C1=CC(OCC2=CC=CC=C2)=C(OCC2=CC=CC=C2)C(OCC2=CC=CC=C2)=C1
InChIKey
InChIKey=XDSLNGWRTUYPDS-XDSPJLLDSA-N
Formula
C40H34O5
Mass
594.707
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
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Subclass
Flavans
- Level 5 Flavan-4-ols
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Subclass
Flavans
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Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavans
Intermediate Tree Nodes
Not available
Direct Parent
Flavan-4-ols
Alternative Parents
4-hydroxyflavonoids Naphthopyrans Naphthalenes 1-benzopyrans Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyrans Secondary alcohols Oxacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-hydroxyflavonoid - Flavan-4-ol - Hydroxyflavonoid - Naphthopyran - Chromane - Benzopyran - Naphthalene - 1-benzopyran - Phenol ether - Phenoxy compound - Alkyl aryl ether - Pyran - Monocyclic benzene moiety - Benzenoid - Secondary alcohol - Oxacycle - Ether - Organoheterocyclic compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - 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