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Structure Information
Structure

Compound Identification

SMILES

CC1(C)CC(COC(=O)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C3=CC=CC=C23)CC(C)(C)N1O

InChIKey

InChIKey=JVRALYMPNFPWDG-UHFFFAOYSA-N

Formula

C31H31NO3

Mass

465.593

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Pyrenes

Subclass

Benzopyrenes

Intermediate Tree Nodes

Not available

Direct Parent

Benzopyrenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzo-a-pyrene - Chrysene - Anthracene carboxylic acid - Anthracene carboxylic acid or derivatives - Anthracene - Phenanthrene - 2-naphthalenecarboxylic acid - 1-naphthalenecarboxylic acid or derivatives - 2-naphthalenecarboxylic acid or derivatives - Piperidine - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - N-organohydroxylamine - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzopyrenes. These are organic compounds containing a benzene fused to a pyrene(benzo[def]phenanthrene) ring system.

External Descriptors

Not available

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