Compound Identification
SMILES
IC1=CC=CC2=C1O[C@H](CC2)C1=CC=CC=C1
InChIKey
InChIKey=RCTKLQHJAXZSCK-CQSZACIVSA-N
Formula
C15H13IO
Mass
336.172
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
- Subclass Flavans
-
Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavans
Intermediate Tree Nodes
Not available
Direct Parent
Flavans
Alternative Parents
1-benzopyrans Alkyl aryl ethers Benzene and substituted derivatives Aryl iodides Oxacyclic compounds Organoiodides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavan - Chromane - Benzopyran - 1-benzopyran - Alkyl aryl ether - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Benzenoid - Organoheterocyclic compound - Ether - Oxacycle - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organoiodide - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavans. These are compounds containing a flavan moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran skeleton.
External Descriptors
Not available