Compound Identification
SMILES
ON=C(COC1=CC2=C(C=C1)C(=O)C1=C(O2)C(=O)OC2=CC=CC=C12)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=JZRBAKFQJKBJKQ-UHFFFAOYSA-N
Formula
C24H14ClNO6
Mass
447.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
- Subclass Rotenoids
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Class
Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Rotenoids
Intermediate Tree Nodes
Not available
Direct Parent
Rotenoids
Alternative Parents
Isoflavones Coumarins and derivatives Chromones Phenol ethers Pyranones and derivatives Chlorobenzenes Alkyl aryl ethers Aryl chlorides Ketoximes Heteroaromatic compounds Lactones Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chromeno-3,4b-chromene - Isoflavone - Chromone - Coumarin - Benzopyran - 1-benzopyran - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Pyranone - Aryl halide - Benzenoid - Pyran - Monocyclic benzene moiety - Aryl chloride - Ketoxime - Heteroaromatic compound - Lactone - Ether - Oxacycle - Organoheterocyclic compound - Organic oxide - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as rotenoids. These are phenolic compounds containing a cis-fused tetrahydrochromeno[3,4-b]chromene nucleus. Many rotenoids contain an additional ring, e.g. rotenone. They are isoflavonoids characterized by the presence of an extra carbon atom in an additional heterocyclic ring.
External Descriptors
Not available