Compound Identification
SMILES
[Na+].[Na+].COC1=CC(=C(OC)C=C1N=NC1C(C)=NN(C1=O)C1=CC=C(C=C1)S([O-])(=O)=O)S(=O)(=O)CCOS([O-])(=O)=O
InChIKey
InChIKey=JDPMQBDNRSLOKS-UHFFFAOYSA-L
Formula
C20H20N4Na2O12S3
Mass
650.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
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 Dimethoxybenzenes 1-sulfo,2-unsubstituted aromatic compounds Methoxyanilines Benzenesulfonyl compounds Phenoxy compounds Anisoles Alkyl aryl ethers Sulfuric acid monoesters Pyrazolones Alkyl sulfates Sulfones Organosulfonic acids Azo compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic sodium salts Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzenesulfonate - Dimethoxybenzene - P-dimethoxybenzene - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Methoxyaniline - Benzenesulfonyl group - Methoxybenzene - Anisole - Phenol ether - Phenoxy compound - Alkyl aryl ether - Monocyclic benzene moiety - Pyrazolinone - Sulfuric acid monoester - Sulfate-ester - Benzenoid - Alkyl sulfate - Sulfuric acid ester - Organic sulfuric acid or derivatives - Pyrazoline - Sulfone - 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 - Azacycle - Organoheterocyclic compound - Organic alkali metal salt - Ether - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Carbonyl group - Organic sodium salt - Hydrocarbon derivative - Organic salt - Organic oxide - 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