Compound Identification
SMILES
O=C(OC1OC(=O)C2=CC=CC=C12)C1=C(CC2CC(=O)N12)SC1=NC=CC=N1
InChIKey
InChIKey=RTSNZWHKKDYLLD-UHFFFAOYSA-N
Formula
C19H13N3O5S
Mass
395.39
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 Benzofuranones Phthalides Aryl thioethers Pyrroline carboxylic acids Azepines Vinylogous thioesters Benzenoids Dicarboxylic acids and derivatives Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Enoate esters Tertiary carboxylic acid amides Lactones Thioenol ethers Azetidines Sulfenyl compounds Acetals Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbapenem - Alpha-amino acid or derivatives - Phthalide - Benzofuranone - Isobenzofuranone - Isocoumaran - Aryl thioether - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Pyrimidine - Dicarboxylic acid or derivatives - Benzenoid - Vinylogous thioester - Enoate ester - Tertiary carboxylic acid amide - Pyrroline - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Azetidine - Thioenolether - Carboxamide group - Lactone - Carboxylic acid ester - Acetal - Oxacycle - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organopnictogen compound - Organosulfur compound - Organonitrogen compound - Organooxygen 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