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)NC2=NCCS2)=C1CCC(O)=O
InChIKey
InChIKey=LARGAKJXDATPEB-UHFFFAOYSA-K
Formula
C37H36ClFeN6O3S
Mass
736.09
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Tetrapyrroles and derivatives
-
Subclass
Metallotetrapyrroles
- Level 5 Metalloporphyrins
-
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 Substituted pyrroles Thiazolines Heteroaromatic compounds Isothioureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic transition metal salts Carboximidamides Organic metal halides Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic chloride salts Organic oxides Carbonyl compounds Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Metalloporphyrin - Porphyrin - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Meta-thiazoline - Isothiourea - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic metal halide - Azacycle - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic transition metal salt - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organonitrogen compound - Organic salt - Organic chloride salt - Organooxygen compound - 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