Compound Identification
SMILES
CO\N=C\C(=O)N[C@]1(S[C@H]2CC(=O)N2C(C(O)=O)=C1CSC1=NN=C(COCC(O)=O)S1)C1=CSC(N)=N1
InChIKey
InChIKey=JWQZSFRGBFYLRZ-YHJVNKRYSA-N
Formula
C19H19N7O8S4
Mass
601.64
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Cephems 2,4-disubstituted thiazoles Alkylarylthioethers 1,3-thiazines 2-amino-1,3-thiazoles Dicarboxylic acids and derivatives Thiadiazoles Tertiary carboxylic acid amides N,S-acetals Heteroaromatic compounds Secondary carboxylic acid amides Oxime ethers Amino acids Azetidines Sulfenyl compounds Dialkylthioethers Azacyclic compounds Dialkyl ethers Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Cephem - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Meta-thiazine - 1,3-thiazol-2-amine - Dicarboxylic acid or derivatives - Tertiary carboxylic acid amide - Thiadiazole - Heteroaromatic compound - Azole - N,s-acetal - Beta-lactam - Thiazole - Lactam - Carboxamide group - Azetidine - Amino acid - Secondary carboxylic acid amide - Oxime ether - Azacycle - Organoheterocyclic compound - Dialkylthioether - Carboxylic acid - Sulfenyl compound - Dialkyl ether - Hemithioaminal - Ether - Thioether - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - 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