Compound Identification
SMILES
COC(=O)[C@H]1O[C@H](CN)[C@H]1SC1=C(N2[C@@H]([C@@H]([C@@H](C)O)C2=O)[C@H]1C)C(O)=O
InChIKey
InChIKey=ZAUYJKNUMMZPJI-YZHITQOISA-N
Formula
C16H22N2O7S
Mass
386.42
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
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Subclass
Carbohydrates and carbohydrate conjugates
- Level 5 Sugar acids and derivatives
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Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Sugar acids and derivatives - Sugar amino acids and derivatives
Direct Parent
Oxetane amino acids and derivatives
Alternative Parents
Carbapenems Alpha amino acids and derivatives Pyrroline carboxylic acids Azepines Vinylogous thioesters Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Methyl esters Amino acids Secondary alcohols Azetidines Thioenol ethers Oxetanes Dialkyl ethers Carboxylic acids Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Oxetane amino acid - Carbapenem - Alpha-amino acid or derivatives - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Dicarboxylic acid or derivatives - Vinylogous thioester - Beta-lactam - Pyrroline - Tertiary carboxylic acid amide - Methyl ester - Secondary alcohol - Amino acid or derivatives - Lactam - Azetidine - Carboxylic acid ester - Amino acid - Thioenolether - Carboxamide group - Oxetane - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Amine - Carbonyl group - Organic nitrogen compound - Organic oxide - Primary amine - Hydrocarbon derivative - Alcohol - Organosulfur compound - Organonitrogen compound - Primary aliphatic amine - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as oxetane amino acids and derivatives. These are sugar amino acids containing an oxetane ring between the carboxy- and the amino terminals of the amino acid chain.
External Descriptors
Not available