Structure Information
Structure

Compound Identification

SMILES

CC1=C2N[C@](C)([C@H]3N=C(C(C)=C4N=C(C=C5N=C1[C@](C)(CC(N)=O)[C@H]5CCC(O)=O)C(C)(C)[C@H]4CCC(O)=O)[C@@](C)(CCC(O)=O)[C@@H]3CC(O)=O)[C@](C)(CC(N)=O)[C@H]2CCC(O)=O

InChIKey

InChIKey=JJMDOVLPFPOLFZ-RHRLNISKSA-N

Formula

C45H62N6O12

Mass

879.021

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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 - Pentacarboxylic acid or derivatives - Delta amino acid or derivatives - Fatty amide - Fatty acyl - Pyrrolidine - Pyrroline - Amino acid - Ketimine - Amino acid or derivatives - Primary carboxylic acid amide - Carboxamide group - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Enamine - Azacycle - Organopnictogen compound - Imine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - 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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