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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Tetrapyrroles and derivatives
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Subclass
Corrinoids
- Level 5 Precorrins
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Subclass
Corrinoids
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Class
Tetrapyrroles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Tetrapyrroles and derivatives
Subclass
Corrinoids
Intermediate Tree Nodes
Not available
Direct Parent
Precorrins
Alternative Parents
Metallotetrapyrroles Asparagine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Fatty acid esters N-acyl amines Organic perchlorate salts Organic perchlorates Alkanesulfonic acids Tertiary carboxylic acid amides Sulfonyls Pyrrolines Pyrrolidines Organosulfonic acids Ketimines Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Carbene-type 1,3-dipolar compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organic cobalt salts Organic oxides Carbonyl compounds Organic zwitterions
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