Compound Identification
SMILES
COCCOCCOCC1N(CCN(CC(O)=O)CC(O)=O)CC23C4=C5C6=C7C8=C9C%10=C%11C%12=C%13C%14=C%15C%16=C%12C%12=C%17C%16=C%16C%18=C%15C%15=C%14C%14=C%19C%13=C%11C%11=C9C(=C47)C4=C2C2=C(C%19=C%114)C%14=C4C%15=C7C%18=C9C%16=C%11C%17=C(C8=C%10%12)C6=C%11C6=C9C8=C7C4=C2C13C8=C56
InChIKey
InChIKey=PLHRSJFEEPICDT-UHFFFAOYSA-N
Formula
C74H26N2O7
Mass
1055.029
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenanthrenes and derivatives
- Subclass Triphenylenes
-
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 Naphthalenes Alpha amino acids Isoindolines Aralkylamines N-alkylpyrrolidines Dicarboxylic acids and derivatives Trialkylamines Amino acids Dialkyl ethers Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chrysene - Triphenylene - Alpha-amino acid - Alpha-amino acid or derivatives - Naphthalene - Isoindoline - Isoindole or derivatives - Aralkylamine - Dicarboxylic acid or derivatives - N-alkylpyrrolidine - Pyrrolidine - Amino acid or derivatives - Amino acid - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Azacycle - Ether - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Carbonyl group - 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