Compound Identification
SMILES
C[C@@H](O)[C@@H]1C2C(C)C(SC3CCC(\C=C\N4CCC4)N(C)C3)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=CSOXVQIXWZNYSX-XUAYVZPQSA-N
Formula
C21H31N3O4S
Mass
421.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Carbapenems
- Level 6 Thienamycins
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Level 5
Carbapenems
-
Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Carbapenems
Direct Parent
Thienamycins
Alternative Parents
Alpha amino acids and derivatives Pyrroline carboxylic acids Azepines Vinylogous thioesters Piperidines Tertiary carboxylic acid amides Trialkylamines Thioenol ethers Secondary alcohols Amino acids Azetidines Allylamines Sulfenyl compounds Azacyclic compounds Enamines Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Thienamycin - Alpha-amino acid or derivatives - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Piperidine - Vinylogous thioester - Pyrroline - Tertiary carboxylic acid amide - Carboxamide group - Amino acid - Azetidine - Secondary alcohol - Tertiary amine - Thioenolether - Tertiary aliphatic amine - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Enamine - Sulfenyl compound - Monocarboxylic acid or derivatives - Carboxylic acid - Allylamine - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Alcohol - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thienamycins. These are beta-lactam antibiotics that differ from penicillins in having the thiazolidine sulfur atom replaced by carbon, the sulfur then becoming the first atom in the side chain.
External Descriptors
Not available