Compound Identification
SMILES
NC1=NC(=CS1)C(=N/OCC1=NOC=C1)\C(=O)NC1[C@H]2SCC(CSC3=NN=NN3CC=C)(CN2C1=O)C(O)=O
InChIKey
InChIKey=GHFPSPQULSQKAR-YJJFMSLDSA-N
Formula
C21H22N10O6S3
Mass
606.65
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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Cephams Alkylarylthioethers 2,4-disubstituted thiazoles Thiazinanes 2-amino-1,3-thiazoles Tetrazoles Tertiary carboxylic acid amides Heteroaromatic compounds Isoxazoles Azetidines Amino acids Secondary carboxylic acid amides Sulfenyl compounds Dialkylthioethers Thiohemiaminal derivatives Carboxylic acids Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Cepham - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - 1,3-thiazinane - 1,3-thiazol-2-amine - Azole - Beta-lactam - Isoxazole - Tertiary carboxylic acid amide - Tetrazole - Thiazole - Heteroaromatic compound - Carboxamide group - Lactam - Secondary carboxylic acid amide - Amino acid - Azetidine - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Hemithioaminal - Carboxylic acid - Thioether - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available