Compound Identification
SMILES
C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(C3=CN4C=NC(SCC5=CC=CC=C5)=C4S3)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=XNPVDUSATWNSMK-JQHQGBHXSA-N
Formula
C22H21N3O4S2
Mass
455.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
- Level 5 Carbapenems
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Subclass
Beta lactams
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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 Alkylarylthioethers Azepines N-substituted imidazoles Benzene and substituted derivatives Thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary alcohols Azetidines Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbapenem - Alpha-amino acid or derivatives - Aryl thioether - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Alkylarylthioether - N-substituted imidazole - Monocyclic benzene moiety - Benzenoid - Imidazole - Azole - Heteroaromatic compound - Pyrroline - Tertiary carboxylic acid amide - Thiazole - Secondary alcohol - Azetidine - Carboxamide group - Azacycle - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Monocarboxylic acid or derivatives - Thioether - Alcohol - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic 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