Compound Identification
SMILES
COc1cc(OC[C@@H](O)CCl)c2c(c1)oc1COc3cc(OC)c(OC)cc3-c1c2=O
InChIKey
InChIKey=MJOUOPXVHSUJCP-NSHDSACASA-N
Formula
C22H21ClO8
Mass
448.85
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Rotenoids
Intermediate Tree Nodes
Not available
Direct Parent
Rotenones
Alternative Parents
Isoflavones Chromones Anisoles Pyranones and derivatives Alkyl aryl ethers Vinylogous esters Heteroaromatic compounds Secondary alcohols Chlorohydrins Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Rotenone or derivatives - Isoflavone - Chromone - Benzopyran - 1-benzopyran - Anisole - Phenol ether - Alkyl aryl ether - Pyranone - Pyran - Benzenoid - Vinylogous ester - Heteroaromatic compound - Secondary alcohol - Chlorohydrin - Halohydrin - Organoheterocyclic compound - Ether - Oxacycle - Organic oxygen compound - Alkyl chloride - Organohalogen compound - Organochloride - Organooxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Alkyl halide - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as rotenones. These are rotenoids with a structure based on a 6a,12a-dihydrochromeno[3,4-b]chromen-12(6H)-one skeleton.
External Descriptors
Not available