Structure Information
Structure

Compound Identification

SMILES

CN1[C@@H](CCC1=O)C(=O)NCC1=C(Cl)C(=CC=C1)C(F)(F)F.CN(CC1=CN=C2N=C(N)N=C(N)C2=N1)C1=CC=C(C=C1)C(=O)N[C@@H](CCC(O)=O)C(O)=O

InChIKey

InChIKey=MECNOWMHSXCPNL-RFSNLKLESA-N

Formula

C34H36ClF3N10O7

Mass

789.17

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pteridines and derivatives

Subclass

Pterins and derivatives

Intermediate Tree Nodes

Pteroic acids and derivatives - Folic acids and derivatives

Direct Parent

Folic acids

Alternative Parents

Molecular Framework

Not available

Substituents

Folic acid - Glutamic acid or derivatives - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Hippuric acid - Proline or derivatives - Hippuric acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Trifluoromethylbenzene - Aminobenzamide - Aminobenzoic acid or derivatives - Benzoic acid or derivatives - Benzamide - Benzoyl - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Dialkylarylamine - Aniline or substituted anilines - Aralkylamine - Chlorobenzene - Aminopyrimidine - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Dicarboxylic acid or derivatives - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Pyrazine - Pyrimidine - Tertiary carboxylic acid amide - Pyrrolidine - Heteroaromatic compound - Lactam - Secondary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Amino acid - Carboxamide group - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl halide - Amine - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary amine - Alkyl fluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as folic acids. These are heterocyclic compounds based on the 4-[(pteridin-6-ylmethyl)amino]benzoic acid skeleton conjugated with one or more L-glutamate units.

External Descriptors

Not available

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