Structure Information
Structure

Compound Identification

SMILES

CC1OC(=O)CC2(C)C(CCC([O-])=O)C3=CC4=[N+]5C(CC6(C)N7C(=CC8=[N+]9C(=C(CC([O-])=O)C8(C)CCC([O-])=O)C12N3[Co]579)C(CCC([O-])=O)=C6CC([O-])=O)=C(CCC([O-])=O)C4(C)CC([O-])=O

InChIKey

InChIKey=BFOLHDVSWWNDKC-UHFFFAOYSA-E

Formula

C45H45CoN4O16

Mass

956.803

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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 - Sesterterpenoid - Metallotetrapyrrole skeleton - Delta valerolactone - Delta_valerolactone - Oxane - Pyrroline - Pyrrolidine - Carboxylic acid ester - Carboxylic acid salt - Lactone - Oxacycle - Azacycle - Organic metal salt - Organic transition metal salt - Carboxylic acid derivative - Carboxylic acid - Metalloheterocycle - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Organic oxide - Organic salt - Organic anion - 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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