Compound Identification
SMILES
COC1(OC)C2=C3C4=C5C6=C7C8=C9C%10=C%11C%12=C%13C%14=C%15C%16=C%17C%13=C%10C%10=C%17C%13=C%17C%16=C%16C%15=C%15C%18=C%19C%20=C(C%12=C%14%18)C(=C8%11)C6=C%20C4=C4C%19=C%15C6=C%16C8=C%17C%11=C(C%12=C%14C(C%10=C9C%14=C7C5=C2%12)=C%13%11)C1=C8C6=C34
InChIKey
InChIKey=XLGPDMMEHRCMFQ-UHFFFAOYSA-N
Formula
C63H6O2
Mass
794.739
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
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Triphenylene - Chrysene - Anthracene - Ketal - Acetal - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic 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