Compound Identification
SMILES
[Fe++].CNC(=O)C(N)CSC(C)C1=C2[N-]C(C=C3N=C(C=C4[N-]C(=CC5=NC(=C2)C(C)=C5C(C)SCC(N)C(=O)NC)C(C)=C4CCC(O)=O)C(CCC(O)=O)=C3C)=C1C
InChIKey
InChIKey=WFVBWSTZNVJEAY-UHFFFAOYSA-L
Formula
C42H52FeN8O6S2
Mass
884.89
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 Alpha amino acid amides Cysteine and derivatives Substituted pyrroles Dicarboxylic acids and derivatives Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Sulfenyl compounds Organic transition metal salts Azacyclic compounds Carboxylic acids Dialkylthioethers Hydrocarbon derivatives Monoalkylamines Carbonyl compounds Organic oxides Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Metalloporphyrin - Porphyrin - Alpha-amino acid amide - Cysteine or derivatives - Alpha-amino acid or derivatives - Dicarboxylic acid or derivatives - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Carboxamide group - Amino acid - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic transition metal salt - Dialkylthioether - Thioether - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Primary amine - Organic salt - Organic zwitterion - Carbonyl group - Organic oxide - 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