Compound Identification
SMILES
COC(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C1=NC=C(N1)C1=CC=C(C=C1)C1=C2C3CCC(C)(C3)C2=C(C=C1)C1=CC=C(C=C1)C1=CN=C(N1)[C@H]1CCCN1C(=O)[C@@H](NC(=O)OC)C(C)C
InChIKey
InChIKey=UIHXYZAZKPICBE-KOCKCLBMSA-N
Formula
C52H62N8O6
Mass
895.118
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
P-terphenyls Valine and derivatives Alpha amino acid amides Phenylimidazoles Tetralins Indanes N-acylpyrrolidines Tertiary carboxylic acid amides Methylcarbamates Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Para-terphenyl - Terphenyl - Valine or derivatives - Alpha-amino acid amide - 5-phenylimidazole - 4-phenylimidazole - Alpha-amino acid or derivatives - Tetralin - Indane - N-acylpyrrolidine - Monocyclic benzene moiety - Benzenoid - Methylcarbamate - Azole - Imidazole - Heteroaromatic compound - Carbamic acid ester - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - 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