Compound Identification
SMILES
CCCCCCC1=CC(C#CC2=CC(=CC(=C2)C#CC2=C(CCCCCC)C=C(C#CC3=CC=C(OC(=O)C4=CC(C)(C)N([O])C4(C)C)C=C3)C(CCCCCC)=C2)C#CC2=C(CCCCCC)C=C(C#CC3=CC=C(OC(=O)C4=CC(C)(C)N([O])C4(C)C)C=C3)C(CCCCCC)=C2)=C(CCCCCC)C=C1C#CC1=CC=C(OC(=O)C2=CC(C)(C)N([O])C2(C)C)C=C1
InChIKey
InChIKey=XWGNYMLJBZEDQU-UHFFFAOYSA-N
Formula
C117H138N3O9
Mass
1730.403
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
Phenol esters Tricarboxylic acids and derivatives Pyrroline carboxylic acids Phenoxy compounds Enoate esters Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Phenol ester - Tricarboxylic acid or derivatives - Phenoxy compound - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Pyrroline - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - 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