Compound Identification
SMILES
CNC1=NN=C(SCC2=C(N3[C@H](SC2)[C@H](N)C3=O)C(O)=O)S1
InChIKey
InChIKey=SMMCOWGSFHSCMY-SVGQVSJJSA-N
Formula
C11H13N5O3S3
Mass
359.44
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
Cephems 2-amino-5-substituted-1,3,4-thiadiazoles Alkylarylthioethers 1,3-thiazines Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids Azetidines Thiohemiaminal derivatives Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Dialkylthioethers Carboxylic acids Carbonyl compounds Organic oxides Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Cephem - Aryl thioether - 2-amino-5-substituted-1,3,4-thiadiazole - Alkylarylthioether - Meta-thiazine - 2-amino-1,3,4-thiadiazole - Azole - Beta-lactam - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiadiazole - Azetidine - Amino acid - Carboxamide group - Lactam - Organoheterocyclic compound - Sulfenyl compound - Hemithioaminal - Thioether - Dialkylthioether - Monocarboxylic acid or derivatives - Carboxylic acid - Azacycle - Primary amine - Organic oxide - Primary aliphatic amine - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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