Structure Information
Structure

Compound Identification

SMILES

CC12CC3=C(CCC(O)=O)C(C)(CC(O)=O)C(C=C4NC(C)(C5=C(CC(O)=O)C(C)(CCC(O)=O)C(CC(=N1)C(CCC(O)=O)=C2CC(O)=O)=N5)C(C)(CC(O)=O)C4CCC(O)=O)=N3

InChIKey

InChIKey=SOHWQLUTRKYCGZ-UHFFFAOYSA-N

Formula

C44H54N4O16

Mass

894.928

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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 - Diterpenoid - Pyrrolidine - Ketimine - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Enamine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Organic oxygen compound - Imine - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Carbonyl group - Organic nitrogen 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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