Compound Identification
SMILES
C[C@@H](O)C1C2CC(C3=CSC(=C3)C(=O)N(C)C)=C(N2C1=O)C(=O)OCOC(=O)C(C)(C)C
InChIKey
InChIKey=KQUJLRLPXMQIAQ-OLQXHTCTSA-N
Formula
C22H28N2O7S
Mass
464.53
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 Thiophene carboxamides Pyrroline carboxylic acids 2-heteroaryl carboxamides Acylals Azepines Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Enoate esters Secondary alcohols Azetidines Acetals Azacyclic compounds Organopnictogen compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbapenem - Alpha-amino acid or derivatives - 2-heteroaryl carboxamide - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Azepine - Acylal - Dicarboxylic acid or derivatives - Heteroaromatic compound - Pyrroline - Tertiary carboxylic acid amide - Alpha,beta-unsaturated carboxylic ester - Thiophene - Enoate ester - Azetidine - Secondary alcohol - Carboxamide group - Carboxylic acid ester - Acetal - Azacycle - Carboxylic acid derivative - Alcohol - Organic oxide - Organonitrogen compound - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen 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