Compound Identification
SMILES
COC1=C(OC(=O)CCCCC2CCSS2)C=CC(C=C2CCCC(=CC3=CC(OC)=C(OC(=O)CCCCC4CCSS4)C=C3)C2=O)=C1
InChIKey
InChIKey=MXHCYEXTUGNNNW-UHFFFAOYSA-N
Formula
C38H46O7S4
Mass
743.02
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
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
Lipoic acids and derivatives Phenol esters Phenoxy compounds Methoxybenzenes Anisoles Fatty acid esters Alkyl aryl ethers Dicarboxylic acids and derivatives 1,2-dithiolanes Organic disulfides Cyclic ketones Carboxylic acid esters Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Lipoic_acid_derivative - Phenol ester - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Dicarboxylic acid or derivatives - Benzenoid - Dithiolane - 1,2-dithiolane - Carboxylic acid ester - Cyclic ketone - Ketone - Organic disulfide - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic oxide - Organic oxygen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic 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