Structure Information
Structure

Compound Identification

SMILES

[Co++].[O-][Cl](=O)(=O)=O.CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)C(=O)[C@H](CC(=O)N\C1=C2\N=C(\C(\C)=C3/[N-][C@@](C)([C@@H]4N=C(\C(C)=C5/N=C1C(C)(C)[C@@H]5CCC(=O)OCCC)[C@](C)(CCC(=O)OCCC)[C@H]4CC(=O)OCCC)[C@@](C)(CC(=O)OCCC)[C@@H]3CCC(=O)OCCC)[C@@](C)(CC(=O)OCCC)[C@@H]2CCC(=O)OCCC)NC(=O)CCCCCS(O)(=O)=O

InChIKey

InChIKey=OKIUQPVCHCNOCO-WARPQZSKSA-L

Formula

C108H182ClCoN7O24S

Mass

2089.11

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Tetrapyrroles and derivatives

Subclass

Corrinoids

Intermediate Tree Nodes

Not available

Direct Parent

Precorrins

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Precorrin - Metallotetrapyrrole skeleton - Asparagine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Fatty acid ester - Fatty amide - Organic perchlorate - Fatty acyl - Organic perchlorate salt - N-acyl-amine - Pyrrolidine - Pyrroline - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Tertiary carboxylic acid amide - Alkanesulfonic acid - Carboxamide group - Carboxylic acid ester - Ketimine - Organic chlorate - Secondary carboxylic acid amide - Propargyl-type 1,3-dipolar organic compound - Carbene-type 1,3-dipolar compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Organic transition metal salt - Organic zwitterion - Organic cobalt salt - Carbonyl group - Organic oxygen compound - Imine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as precorrins. These are intermediates formed by methylation at one or more of the four rings prior to the formation of the macrocyclic corrin ring.

External Descriptors

Not available

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