Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)C1=C(OCC(O)=O)C=CC(=C1)C1=CC=C(C=C1)C1=C(CC2=CC=CC=C2)SC2=CC=CC=C12
InChIKey
InChIKey=CHIIJWJJKBQFAG-UHFFFAOYSA-N
Formula
C38H32O6S
Mass
616.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Diarylheptanoids
- Subclass Linear diarylheptanoids
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Class
Diarylheptanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Diarylheptanoids
Subclass
Linear diarylheptanoids
Intermediate Tree Nodes
Not available
Direct Parent
Linear diarylheptanoids
Alternative Parents
M-terphenyls Biphenyls and derivatives Phenoxyacetic acid derivatives 1-benzothiophenes Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Thiophenes Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Meta-terphenyl - Terphenyl - Biphenyl - Phenoxyacetate - 1-benzothiophene - Benzothiophene - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Thiophene - Ether - Carboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxygen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.
External Descriptors
Not available