Compound Identification
SMILES
COC(=O)[C@H]1N([C@@H](C(=O)OC)C23C4=C5C6=C7C8=C9C%10=C%11C%12=C%13C%14=C%10C%10=C9C9=C%15C%16=C%17C%18=C%19C%20=C%21C%22=C%23C%24=C%25C%26=C(C6=C8C%11=C%26C%12=C%24C%22=C%13C%20=C%14C%18=C%10%16)C6=C%25C8=C(C%10=C%11C(C%19=C%21C%10=C%238)=C%17C(=C%15C4=C79)C12%11)C3=C56)C(=O)CCCCCCCCC(=O)NC1=CC=CC=C1
InChIKey
InChIKey=FSLVQXYTXFVMEF-PHRHHWEQSA-N
Formula
C82H30N2O6
Mass
1139.15
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenanthrenes and derivatives
- Subclass Triphenylenes
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Class
Phenanthrenes and derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenanthrenes and derivatives
Subclass
Triphenylenes
Intermediate Tree Nodes
Not available
Direct Parent
Triphenylenes
Alternative Parents
Chrysenes Bicyclic amino acids and derivatives Alpha amino acid esters N-acyl-alpha amino acids Naphthalenes Anilides Isoindolines Pyrrolidine carboxylic acids N-arylamides N-acylpyrrolidines Fatty amides Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Methyl esters Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chrysene - Triphenylene - Bicyclic amino acid - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Alpha-amino acid or derivatives - Naphthalene - Anilide - Isoindole or derivatives - Isoindoline - N-acylpyrrolidine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - N-arylamide - Fatty acyl - Dicarboxylic acid or derivatives - Fatty amide - Monocyclic benzene moiety - Methyl ester - Tertiary carboxylic acid amide - Pyrrolidine - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as triphenylenes. These are compounds containing a triphenylene moiety, which consists of four fused benzene rings forming a 9,10-benzo[l]phenanthrene.
External Descriptors
Not available