Compound Identification
SMILES
CO[C@H](C1=C(C=CC(COC2=CC3=C(CCC[C@]33C[C@H]3C(O)=O)C=C2)=C1)C1=CC(Cl)=CC=C1)C(C)(C)C
InChIKey
InChIKey=BXWNXRWNQIUEIN-LBRLCBGXSA-N
Formula
C32H35ClO4
Mass
519.08
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Biphenyls and derivatives
- Level 5 Chlorinated biphenyls
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Subclass
Biphenyls and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Chlorinated biphenyls
Alternative Parents
Tetralins Phenylpropanes Benzylethers Phenol ethers Chlorobenzenes Alkyl aryl ethers Cyclopropanecarboxylic acids Aryl chlorides Monocarboxylic acids and derivatives Dialkyl ethers Carboxylic acids Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Chlorinated biphenyl - Tetralin - Phenylpropane - Benzylether - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Cyclopropanecarboxylic acid - Cyclopropanecarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Organic oxygen compound - Carbonyl group - Organochloride - Organohalogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as chlorinated biphenyls. These are organic compounds containing at least one chlorine atom attached to either benzene ring of the biphenyl moiety.
External Descriptors
Not available