Compound Identification
SMILES
[Na+].[Na+].[Na+].CC1=NN(C(=O)C1N=NC1=C(C=CC(NC2=NC(NC3=C(C)C=C(C=C3)S([O-])(=O)=O)=NC(Cl)=N2)=C1)S([O-])(=O)=O)C1=CC(Cl)=C(C=C1Cl)S([O-])(=O)=O
InChIKey
InChIKey=NMXIYULPLGQHTR-UHFFFAOYSA-K
Formula
C26H17Cl3N9Na3O10S3
Mass
886.97
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds 1,3,5-triazine-2,4-diamines Aniline and substituted anilines Dichlorobenzenes Toluenes Chloro-s-triazines Pyrazolones Aryl chlorides Sulfonyls Organosulfonic acids Heteroaromatic compounds Azo compounds Organic metal halides Azacyclic compounds Secondary amines Propargyl-type 1,3-dipolar organic compounds Organic oxides Carbonyl compounds Organic sodium salts Organochlorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzenesulfonate - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Arylsulfonic acid or derivatives - 2,4-diamine-s-triazine - 1,4-dichlorobenzene - Aniline or substituted anilines - Chloro-s-triazine - Halo-s-triazine - Amino-1,3,5-triazine - Aminotriazine - Toluene - Halobenzene - Chlorobenzene - 1,3,5-triazine - Pyrazolinone - Monocyclic benzene moiety - Triazine - Benzenoid - Aryl halide - Aryl chloride - Heteroaromatic compound - Pyrazoline - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Azo compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic metal halide - Azacycle - Organic alkali metal salt - Organoheterocyclic compound - Secondary amine - Organohalogen compound - Organic sodium salt - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - Organic salt - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available