Compound Identification
SMILES
[H][C@@]12COC3=CC(OC)=C(OC)C=C3[C@]1(O)C(=O)C1=C(O2)C2=C(OC(C)(C)C=C2)C=C1
InChIKey
InChIKey=AQBZCCQCDWNNJQ-AUSIDOKSSA-N
Formula
C23H22O7
Mass
410.422
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
8-prenylated isoflavanones Pyranochromenes 2,2-dimethyl-1-benzopyrans Chromones Aryl alkyl ketones Anisoles Alkyl aryl ethers Tertiary alcohols Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Rotenone or derivatives - 8-prenylated isoflavanone - Isoflavanone - Isoflavan - Pyranochromene - 2,2-dimethyl-1-benzopyran - Chromone - Chromane - Benzopyran - 1-benzopyran - Anisole - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Benzenoid - Tertiary alcohol - Ketone - Organoheterocyclic compound - Oxacycle - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - 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
CHEBI:9442 :
cyclic ketone - aromatic ether - organic heteropentacyclic compound - rotenones
LIPIDMAPS (LMPK12060047) :
Rotenoid flavonoids
KEGG (C10535) :
rotenones - Rotenoid flavonoids