Structure Information
Structure

Compound Identification

SMILES

COC(=O)CC[C@@H]1\C2=C(NC(=O)C3=CC(=NC=C3)C3=NC=CC(C)=C3)\C3=N\C(\[C@@H](CCC(=O)OC)C3(C)C)=C(C)/C3=NC([C@H](CC(=O)OC)[C@@]3(C)CCC(=O)OC)[C@]3(C)N=C([C@@H](CCC(=O)OC)[C@]3(C)CC(=O)OC)C(C)=C(N2)[C@@]1(C)CC(=O)OC

InChIKey

InChIKey=XNYOWTPLFNBGOV-FZWYYPFZSA-N

Formula

C64H83N7O15

Mass

1190.402

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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

Aromatic heteropolycyclic compounds

Substituents

Precorrin - Bipyridine - Pyridine carboxylic acid or derivatives - Methylpyridine - Fatty acid ester - Fatty acyl - Pyridine - Heteroaromatic compound - Methyl ester - Pyrroline - Pyrrolidine - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Ketimine - Secondary carboxylic acid amide - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Imine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Amine - Aromatic 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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