Compound Identification
SMILES
[Na+].[Na+].OCCNC(=O)C1=CC(O)(C=CC=CC=C2C(=O)N(CC3=CC=CC=C3S([O-])(=O)=O)N=C2C(=O)NCCO)N(CC2=CC=CC=C2S([O-])(=O)=O)N1
InChIKey
InChIKey=NBUJZFWVURLSAZ-UHFFFAOYSA-L
Formula
C31H32N6Na2O12S2
Mass
790.73
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
-
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 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds N-acylethanolamines Pyrazolones Sulfonyls Organosulfonic acids N-alkylated hydrazones Secondary carboxylic acid amides Alkylhydrazines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Primary alcohols Organic oxides Organic sodium salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - N-acylethanolamine - Monocyclic benzene moiety - Pyrazolinone - Benzenoid - Pyrazoline - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - N-alkylated hydrazone - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Organic alkali metal salt - Alkylhydrazine - Azacycle - Alkanolamine - Alcohol - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrazine derivative - Carbonyl group - Organic sodium salt - Hydrocarbon derivative - Organic oxygen compound - Organic salt - Organic nitrogen compound - 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