Compound Identification
SMILES
CC(C)(C)OC(=O)CN(CCOCCOCCN1CC23C4=C5C6=C7C8=C9C%10=C%11C%12=C%13C%14=C%15C%16=C%17C%18=C%14C(C%14=C8C6=C6C(=C%18%14)C8=C%14C6=C5C2=C2C%14=C5C(=C%178)C%16=C6C8=C%14C%16=C(C2=C58)C3(C1)C1=C2C(=C%10C7=C42)C2=C%11C3=C%13C%154CN(CCOCCOCCN(CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)CC64C%14=C3C2=C%161)=C9%12)CC(=O)OC(C)(C)C
InChIKey
InChIKey=VRXZNTJPTOOBOX-UHFFFAOYSA-N
Formula
C100H76N4O12
Mass
1525.724
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 Tetracarboxylic acids and derivatives Alpha amino acid esters Naphthalenes Isoindolines Aralkylamines N-alkylpyrrolidines Trialkylamines Carboxylic acid esters Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chrysene - Triphenylene - Alpha-amino acid ester - Tetracarboxylic acid or derivatives - Alpha-amino acid or derivatives - Naphthalene - Isoindoline - Isoindole or derivatives - Aralkylamine - N-alkylpyrrolidine - Pyrrolidine - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen 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