Compound Identification
SMILES
[O-][N+](=O)C1=CC=CC=C1\C=C1\SC(N(NCC(=O)SC2=NC3=CC=CC=C3S2)C1=O)C1=CC=CC=C1[N+]([O-])=O
InChIKey
InChIKey=ZSRFOSIUQUTNBE-FYJGNVAPSA-N
Formula
C25H17N5O6S3
Mass
579.62
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
Benzothiazoles Nitrobenzenes Aryl thioethers Nitroaromatic compounds Thiazolidines Thiazoles Heteroaromatic compounds Thioesters Thioenol ethers Carbothioic S-esters Carboxylic acid hydrazides Sulfenyl compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic salts Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - 1,3-benzothiazole - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Benzenoid - Monocyclic benzene moiety - Azole - Thiazolidine - Thiazole - Heteroaromatic compound - Thioenolether - Thiocarboxylic acid ester - Carbothioic s-ester - C-nitro compound - Organic nitro compound - Carboxylic acid hydrazide - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Thiocarboxylic acid or derivatives - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organonitrogen compound - Organic oxygen compound - Organic salt - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic 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