Compound Identification
SMILES
Br.C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(S[C@@H]3CN[C@@H](C3)[C@H](O)[C@@H]3CCNC3)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=NNSRCADEOHVRNH-XNGFCKKMSA-N
Formula
C19H30BrN3O5S
Mass
492.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
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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 Tertiary carboxylic acid amides Pyrrolidines 1,3-aminoalcohols Secondary alcohols Thioenol ethers Amino acids 1,2-aminoalcohols Azetidines Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Dialkylamines Carboxylic acids Hydrobromides Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Thienamycin - Alpha-amino acid or derivatives - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Vinylogous thioester - 1,3-aminoalcohol - Pyrroline - Pyrrolidine - Tertiary carboxylic acid amide - Thioenolether - Carboxamide group - Azetidine - Secondary alcohol - Amino acid or derivatives - Amino acid - 1,2-aminoalcohol - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Alcohol - Organic oxygen compound - Carbonyl group - Hydrobromide - Organic nitrogen compound - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur 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