Structure Information
Structure

Compound Identification

SMILES

[Fe++].[CH]1[CH][CH][CH][CH]1.CCNC(=O)SC1=CC=C(C=C1)C1=C2NC(C=C2)=C(C2=NC(C=C2)=C(C2=NC(C=C2)=C(C2=CC=C1N2)C1=C(C)C=C(C)C=C1C)C1=CC=C(C=C1)C#CC1=CC=C(C=C1)[C]1[CH][CH][CH][CH]1)C1=C(C)C=C(C)C=C1C

InChIKey

InChIKey=YFROMWIHQLXMGY-UHFFFAOYSA-N

Formula

C71H59FeN5OS

Mass

1086.19

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Tetrapyrroles and derivatives

Subclass

Metallotetrapyrroles

Intermediate Tree Nodes

Not available

Direct Parent

Metalloporphyrins

Alternative Parents

Molecular Framework

Not available

Substituents

Metalloporphyrin - Porphyrin - Aryl thioether - Monocyclic benzene moiety - Benzenoid - Pyrrole - Heteroaromatic compound - Thiocarbamic acid derivative - Cyclic olefin - Cycloalkene - Azacycle - Organic transition metal salt - Sulfenyl compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Unsaturated hydrocarbon - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Olefin - Unsaturated aliphatic hydrocarbon - Organopnictogen compound - Hydrocarbon - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as metalloporphyrins. These are polycyclic compounds containing a porphyrin moiety and a metal atom.

External Descriptors

Not available

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