Compound Identification
SMILES
[Na+].COCCOCC1=C(SC=N1)\C=C/SC1=C(N2[C@@H]([C@@H]([C@@H](C)O)C2=O)[C@H]1C)C([O-])=O
InChIKey
InChIKey=NGQDVBTXTVEHEF-MAIVHWJBSA-M
Formula
C19H23N2NaO6S2
Mass
462.51
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 Pyrroline carboxylic acids 4,5-disubstituted thiazoles Azepines Vinylogous thioesters Tertiary carboxylic acid amides Heteroaromatic compounds Thioenol ethers Secondary alcohols Azetidines Carboxylic acid salts Sulfenyl compounds Azacyclic compounds Carboxylic acids Dialkyl ethers Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Organonitrogen compounds Organic zwitterions Organic sodium salts Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbapenem - Alpha-amino acid or derivatives - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - 4,5-disubstituted 1,3-thiazole - Azepine - Vinylogous thioester - Azole - Heteroaromatic compound - Pyrroline - Tertiary carboxylic acid amide - Thiazole - Azetidine - Carboxamide group - Carboxylic acid salt - Secondary alcohol - Thioenolether - Sulfenyl compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organic alkali metal salt - Organic oxygen compound - Organic zwitterion - Alcohol - Carbonyl group - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Organic sodium salt - 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