Structure Information
Structure

Compound Identification

SMILES

CC(C)(O)C#CC1=CC2=C(C=C1)C1=NC2=NC2=NC(=NC3=C4C(=C(N3)N=C3NC(=N1)C1=C3C(OCC(F)(F)F)=C(OCC(F)(F)F)C(OCC(F)(F)F)=C1OCC(F)(F)F)C(OCC(F)(F)F)=C(OCC(F)(F)F)C(OCC(F)(F)F)=C4OCC(F)(F)F)C1=C2C(OCC(F)(F)F)=C(OCC(F)(F)F)C(OCC(F)(F)F)=C1OCC(F)(F)F

InChIKey

InChIKey=WWHNIZGBGIXZMJ-UHFFFAOYSA-N

Formula

C61H36F36N8O13

Mass

1772.945

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Tetrapyrroles and derivatives

Subclass

Phthalocyanines

Intermediate Tree Nodes

Not available

Direct Parent

Phthalocyanines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phthalocyanine skeleton - Isoindole - Isoindole or derivatives - Phenol ether - Alkyl aryl ether - Benzenoid - Ynone - Heteroaromatic compound - Tertiary alcohol - Pyrrole - Ether - Azacycle - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Alkyl halide - Alkyl fluoride - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phthalocyanines. These are cyclic tetrapyrroles that contain a phthalocyanine skeleton, which consists of four isoindole-type units, with the connecting carbon atoms in the macrocycle replaced by nitrogen.

External Descriptors

Not available

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