Compound Identification
SMILES
[Fe++].O=C1OCCOC2=CC=CC=C2C2=C3[N-]C(C=C3)=C3C4=NC(C=C4)=C4C5=CC=C([N-]5)C(=C5C=CC2=N5)C2=CC=CC=C2OCCOC(=O)C2=C(C=C(C1=C2)C(=O)OCCOC1=CC=CC=C31)C(=O)OCCOC1=CC=CC=C41
InChIKey
InChIKey=XWRDYNPQMSMNGD-UHFFFAOYSA-N
Formula
C62H42FeN4O12
Mass
1090.879
Taxonomic Classification
Taxonomy Tree
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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
-
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 Alkyl aryl ethers Benzenoids Pyrroles Heteroaromatic compounds Lactones Carboxylic acid esters Oxacyclic compounds Organic transition metal salts Azacyclic compounds Organonitrogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Metalloporphyrin - Porphyrin - Alkyl aryl ether - Benzenoid - Heteroaromatic compound - Pyrrole - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Ether - Oxacycle - Azacycle - Organic transition metal salt - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organic 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