Structure Information
Structure

Compound Identification

SMILES

CC(=O)NC(=O)OCC1(C)SC2C(NC(=O)COC3=CC=CC=C3)C(=O)N2C1C(=O)OCC1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=HPAOPTDNRPMCDE-UHFFFAOYSA-N

Formula

C26H26N4O10S

Mass

586.57

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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 ester - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Nitrobenzene - Phenol ether - Phenoxy compound - Nitroaromatic compound - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Thiazolidine - Carbamic acid ester - Tertiary carboxylic acid amide - Acetamide - Dicarboximide - Azetidine - Carboxamide group - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Organic 1,3-dipolar compound - Hemithioaminal - Thioether - Organic oxoazanium - Dialkylthioether - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Ether - Azacycle - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - Organonitrogen compound - 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

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