Compound Identification
SMILES
C[C@H](OS([O-])(=O)=O)[C@H]1[C@H]2CC(S\C=C\NC(C)=O)=C(N2C1=O)C(=O)OCC1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=KPAOBEIIWRDBQV-WRWXZLMKSA-M
Formula
C20H20N3O10S2
Mass
526.51
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
-
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 Benzyloxycarbonyls Nitrobenzenes Pyrroline carboxylic acids Nitroaromatic compounds Azepines Sulfuric acid monoesters Alkyl sulfates Vinylogous thioesters Tertiary carboxylic acid amides Enoate esters Acetamides Secondary carboxylic acid amides Azetidines Thioenol ethers Organic oxoazanium compounds Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organic salts Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbapenem - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Nitrobenzene - Nitroaromatic compound - Pyrroline carboxylic acid or derivatives - Pyrroline carboxylic acid - Azepine - Sulfuric acid monoester - Sulfate-ester - Monocyclic benzene moiety - Alkyl sulfate - Sulfuric acid ester - Vinylogous thioester - Benzenoid - Pyrroline - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Tertiary carboxylic acid amide - Organic sulfuric acid or derivatives - Acetamide - Azetidine - Carboxamide group - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Thioenolether - Secondary carboxylic acid amide - Organic oxoazanium - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Sulfenyl compound - Azacycle - Organic salt - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic cation - 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