Structure Information
Structure

Compound Identification

SMILES

CC1(C)C[N+]2([C@H](C(NC(=O)COC3=CC=CC=C3)C2=O)S1=O)C(=O)OCC(Cl)(Cl)Cl

InChIKey

InChIKey=VYWKBVOUNQYGNU-KOJOIQOMSA-O

Formula

C18H20Cl3N2O6S

Mass

498.78

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Penams

Direct Parent

Penicillins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Penicillin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Azetidinecarboxylic acid - Benzenoid - Monocyclic benzene moiety - Quaternary ammonium salt - Thiazolidine - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Sulfoxide - Sulfinyl compound - Azacycle - Carboxylic acid derivative - Ether - Organic nitrogen compound - Alkyl chloride - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Organic cation - 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

Previous Back Next