Compound Identification
SMILES
[Cl-].[Fe+3].CC1=C2[N-]C(C=C3N=C(C=C4[N-]C(=CC5=NC(=C2)C(C=C)=C5C)C(C=C)=C4C)C(C)=C3CCC(=O)N=C2SC=C(N2C2=CC=CC=C2[N+]([O-])=O)C2=CC=CC=C2)=C1CCC(=O)N=C1SC=C(N1C1=CC=CC=C1[N+]([O-])=O)C1=CC=CC=C1
InChIKey
InChIKey=SHOJEBMCWDZISZ-UHFFFAOYSA-M
Formula
C64H50ClFeN10O6S2
Mass
1210.58
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Tetrapyrroles and derivatives
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Subclass
Metallotetrapyrroles
- Level 5 Metalloporphyrins
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Subclass
Metallotetrapyrroles
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Class
Tetrapyrroles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Tetrapyrroles and derivatives
Subclass
Metallotetrapyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Metalloporphyrins
Alternative Parents
Porphyrins Nitrobenzenes Nitroaromatic compounds Substituted pyrroles Thiazoles Heteroaromatic compounds N-acylimines Isothioureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic transition metal salts Organic oxoazanium compounds Carboxylic acids and derivatives Organic metal halides Hydrocarbon derivatives Organic chloride salts Organic oxides Carbonyl compounds Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Metalloporphyrin - Porphyrin - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Azole - Heteroaromatic compound - Pyrrole - Thiazole - Isothiourea - C-nitro compound - Organic nitro compound - N-acylimine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic metal halide - Organic oxoazanium - Azacycle - Organic transition metal salt - Organonitrogen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organic salt - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic zwitterion - Organic chloride salt - 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