Compound Identification
SMILES
C[C@@H](O)[C@@H]1[C@H]2CC(SCCN=CN)=C(N2C1=O)C(O)=O.CC1(C)C[C@@H]1C(=O)N\C(=C/CCCCSC[C@@H](N)C(O)=O)C(O)=O
InChIKey
InChIKey=NCCJWSXETVVUHK-YWQWCIIKSA-N
Formula
C28H43N5O9S2
Mass
657.8
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
N-acyl-alpha amino acids Cysteine and derivatives S-alkyl-L-cysteines D-alpha-amino acids Medium-chain fatty acids Pyrroline carboxylic acids Azepines Vinylogous thioesters Dicarboxylic acids and derivatives Cyclopropanecarboxylic acids and derivatives Unsaturated fatty acids Tertiary carboxylic acid amides Secondary alcohols Thioenol ethers Azetidines Secondary carboxylic acid amides Amino acids Sulfenyl compounds Azacyclic compounds Carboxamidines Carboximidamides Carboxylic acids Dialkylthioethers Formamidines Carbonyl compounds Imines Hydrocarbon derivatives Organic oxides Monoalkylamines
Molecular Framework
Not available
Substituents
Thienamycin - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Cysteine or derivatives - S-alkyl-l-cysteine - Alpha-amino acid - Alpha-amino acid or derivatives - D-alpha-amino acid - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Medium-chain fatty acid - Azepine - Fatty acid - Vinylogous thioester - Fatty acyl - Unsaturated fatty acid - Cyclopropanecarboxylic acid or derivatives - Dicarboxylic acid or derivatives - Tertiary carboxylic acid amide - Pyrroline - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Thioenolether - Secondary carboxylic acid amide - Secondary alcohol - Azacycle - Dialkylthioether - Formamidine - Amidine - Sulfenyl compound - Carboximidamide - Carboxylic acid amidine - Thioether - Carboxylic acid derivative - Carboxylic acid - Carbonyl group - Organic nitrogen compound - Amine - Hydrocarbon derivative - Alcohol - Imine - Primary aliphatic amine - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - 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