Compound Identification
SMILES
C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(S[C@@H]3CN[C@@H](C3)C3CCN(CCO)C3)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=NNBABBDIOHITOY-KLNWDRFJSA-N
Formula
C20H31N3O5S
Mass
425.54
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 N-alkylpyrrolidines Tertiary carboxylic acid amides 1,2-aminoalcohols Trialkylamines Amino acids Thioenol ethers Azetidines Secondary alcohols Dialkylamines Carboxylic acids Monocarboxylic acids and derivatives Sulfenyl compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Thienamycin - Alpha-amino acid or derivatives - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Vinylogous thioester - N-alkylpyrrolidine - Pyrrolidine - Pyrroline - Tertiary carboxylic acid amide - 1,2-aminoalcohol - Amino acid or derivatives - Azetidine - Carboxamide group - Amino acid - Secondary alcohol - Tertiary amine - Thioenolether - Tertiary aliphatic amine - Sulfenyl compound - Secondary amine - Azacycle - Alkanolamine - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Carboxylic acid - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Amine - Primary alcohol - Alcohol - Organic oxide - 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