Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)OO[C@@]12C3=C4C5=C6C7=C8C9=C%10C%11=C%12C%13=C%10C7=C5C5=C%13C7=C%10C5=C4C1=C1C%10=C4C5=C%10C(C%12=C75)=C5C%11=C7C9=C9C8=C8C6=C3[C@]36O[C@]33C2=C2[C@@]1(OOC(C)(C)C)C4=C1C%10=C4C5=C7C5=C9C(=C86)[C@@]6(OOC(C)(C)C)C5=C4[C@]1(OOC(C)(C)C)[C@]2(O)[C@@]36OOC(C)(C)C

InChIKey

InChIKey=VHUABYLEHOLWPR-WMQRSVCKSA-N

Formula

C80H46O12

Mass

1199.236

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenanthrenes and derivatives

Subclass

Triphenylenes

Intermediate Tree Nodes

Not available

Direct Parent

Triphenylenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Chrysene - Triphenylene - 1-aryltetralin lignan - Phenanthrol - Naphthalene - Tetralin - Tertiary alcohol - Dialkyl peroxide - Dialkyl ether - Oxirane - Ether - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - 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

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