Compound Identification
SMILES
C[C@@H](O)[C@@H]1[C@H]2CC(CSCCN)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=WAECJRTXWKRBGD-FTLITQJKSA-N
Formula
C12H18N2O4S
Mass
286.35
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
- Level 5 Carbapenems
-
Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Not available
Direct Parent
Carbapenems
Alternative Parents
Alpha amino acids and derivatives Pyrroline carboxylic acids Azepines Tertiary carboxylic acid amides Amino acids Secondary alcohols Azetidines Dialkylthioethers Carboxylic acids Azacyclic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Monoalkylamines Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Carbapenem - Alpha-amino acid or derivatives - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Pyrroline - Tertiary carboxylic acid amide - Secondary alcohol - Azetidine - Amino acid - Amino acid or derivatives - Carboxamide group - Sulfenyl compound - Thioether - Carboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Dialkylthioether - Azacycle - Alcohol - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as carbapenems. These are beta-lactam derivatives in which the beta-lactam ring shares the nitrogen atom with a pyrrole-2-carboxylic acid.
External Descriptors
Not available