Compound Identification
SMILES
[Fe++].C1CCOC1.C1CCOC1.FC1=CC=CC(F)=C1C1=C2C=CC(=N2)C(=C2[N-]C(C=C2)=C(C2=NC(C=C2)=C(C2=CC=C1[N-]2)C1=C(F)C=CC=C1F)C1=C(F)C=CC=C1F)C1=C(F)C=CC=C1F
InChIKey
InChIKey=OTDPLQLIYDLZMM-UHFFFAOYSA-N
Formula
C52H36F8FeN4O2
Mass
956.718
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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 Fluorobenzenes Aryl fluorides Pyrroles Oxolanes Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic metal halides Organic transition metal salts Hydrocarbon derivatives Organopnictogen compounds Organonitrogen compounds Organic zwitterions Organofluorides
Molecular Framework
Not available
Substituents
Metalloporphyrin - Porphyrin - Fluorobenzene - Halobenzene - Aryl halide - Benzenoid - Monocyclic benzene moiety - Aryl fluoride - Heteroaromatic compound - Pyrrole - Oxolane - Organic metal halide - Oxacycle - Azacycle - Organic transition metal salt - Dialkyl ether - Ether - Organopnictogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - 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