Compound Identification
SMILES
CC1(C)SC2C(NC(=O)C(C(=O)OC3=C(Cl)C(Cl)=C(Cl)C(Cl)=C3Cl)C3=CC=CC=C3)C(=O)N2C1C(O)=O
InChIKey
InChIKey=OLLNYVRJKVLNEO-UHFFFAOYSA-N
Formula
C23H17Cl5N2O6S
Mass
626.71
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Penams
- Level 6 Penicillins
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Level 5
Penams
-
Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Penams
Direct Parent
Penicillins
Alternative Parents
N-acyl-alpha amino acids and derivatives Phenol esters Phenylacetamides Phenoxy compounds Chlorobenzenes 1,3-dicarbonyl compounds Aryl chlorides Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Thiazolidines Secondary carboxylic acid amides Azetidines Carboxylic acid esters Dialkylthioethers Carboxylic acids Azacyclic compounds Thiohemiaminal derivatives Organochlorides Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Penicillin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Phenylacetamide - Phenol ester - Phenoxy compound - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - 1,3-dicarbonyl compound - Thiazolidine - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Thioether - Hemithioaminal - Dialkylthioether - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organohalogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as penicillins. These are organic compounds containing the penicillin core structure, which is structurally characterized by a penam ring bearing two methyl groups at position 2, and an amide group at position 6 [starting from the sulfur atom at position 1].
External Descriptors
Not available