Compound Identification
SMILES
COC1=C2C=C(C(C3=CC=C(C=C3)C(=O)OCOC3C4CC5CC(C4)CC3C5)C3=C(OC)C=C(O)C(=C3)C(C3=CC=C(C=C3)C(=O)OCC3C4CC5CC(C4)CC3C5)C3=C(OC)C=C(O)C(=C3)C(C3=CC=C(C=C3)C(=O)OCOC3C4CC5CC(C4)CC3C5)C3=C(OC)C=C(O)C(=C3)C2C2=CC=C(C=C2)C(=O)OCOC2C3CC4CC(C3)CC2C4)C(O)=C1
InChIKey
InChIKey=AHKMVGFWCVVADI-UHFFFAOYSA-N
Formula
C104H112O19
Mass
1666.021
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
Tetracarboxylic acids and derivatives Benzoic acid esters Benzoyl derivatives Anisoles Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Carboxylic acid esters Polyols Acetals Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Tetracarboxylic acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Anisole - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Carboxylic acid ester - Carboxylic acid derivative - Polyol - Acetal - Ether - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic homopolycyclic 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