Compound Identification
SMILES
N[C@@H](CS)C(O)=O.NC1=NC(=O)C2=NC(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=CN=C2N1
InChIKey
InChIKey=BQPRLFIZRGFXIZ-VNLFUIKHSA-N
Formula
C22H26N8O8S
Mass
562.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pteridines and derivatives
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Subclass
Pterins and derivatives
-
Level 5
Pteroic acids and derivatives
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Level 6
Folic acids and derivatives
- Level 7 Folic acids
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Level 6
Folic acids and derivatives
-
Level 5
Pteroic acids and derivatives
-
Subclass
Pterins and derivatives
-
Class
Pteridines and derivatives
-
Superclass
Organoheterocyclic compounds
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
Glutamic acid and derivatives Hippuric acids N-acyl-alpha amino acids Cysteine and derivatives Aminobenzamides L-alpha-amino acids Aniline and substituted anilines Benzoyl derivatives Phenylalkylamines Aminopyrimidines and derivatives Pyrimidones Secondary alkylarylamines Pyrazines Dicarboxylic acids and derivatives Vinylogous amides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Alkylthiols Azacyclic compounds Carboxylic acids Organopnictogen compounds Hydrocarbon derivatives Organic oxides Monoalkylamines Carbonyl compounds
Molecular Framework
Not available
Substituents
Folic acid - Glutamic acid or derivatives - Hippuric acid or derivatives - Hippuric acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Cysteine or derivatives - Alpha-amino acid - Alpha-amino acid or derivatives - Aminobenzamide - Aminobenzoic acid or derivatives - L-alpha-amino acid - Benzamide - Benzoic acid or derivatives - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - Aminopyrimidine - Secondary aliphatic/aromatic amine - Pyrimidone - Aralkylamine - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Pyrazine - Heteroaromatic compound - Vinylogous amide - Amino acid - Carboxamide group - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxylic acid derivative - Secondary amine - Azacycle - Carboxylic acid - Alkylthiol - Primary amine - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Primary aliphatic amine - Organic oxygen compound - Organic oxide - Organopnictogen compound - Organonitrogen compound - Amine - Organooxygen compound - Organosulfur compound - 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