Compound Identification
SMILES
CC1SC[C@H]2[C@@H](NC(=O)COC3=CC=CC=C3)C(=O)N2C1(O)C(O)=O
InChIKey
InChIKey=VABJMOOPYKRVLE-CKPMOHCVSA-N
Formula
C16H18N2O6S
Mass
366.39
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
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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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Thiomorpholine carboxylic acids and derivatives Phenoxy compounds Phenol ethers Alkyl aryl ethers Alpha hydroxy acids and derivatives Tertiary carboxylic acid amides Beta lactams Tertiary amines Secondary carboxylic acid amides Amino acids Azetidines Alkanolamines Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Dialkylthioethers Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Thiomorpholine-3-carboxylic acid - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Alpha-hydroxy acid - Hydroxy acid - 1,4-thiazinane - Benzenoid - Tertiary carboxylic acid amide - Beta-lactam - Amino acid - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Azetidine - Lactam - Thioether - Dialkylthioether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Ether - Carboxylic acid - Alkanolamine - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen 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