Structure Information
Structure

Compound Identification

SMILES

CC1=NC=C(N1CCOC(=O)[C@@H]1N2[C@H](SC1(C)C)[C@H](NC(=O)COC1=CC=CC=C1)C2=O)[N+]([O-])=O

InChIKey

InChIKey=RIKWZDGIQNDJOR-WSTZPKSXSA-N

Formula

C22H25N5O7S

Mass

503.53

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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 - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - 1,2,5-trisubstituted-imidazole - Phenoxy compound - Nitroaromatic compound - Trisubstituted imidazole - Phenol ether - Nitroimidazole - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - N-substituted imidazole - Thiazolidine - Azole - Tertiary carboxylic acid amide - Imidazole - Heteroaromatic compound - Azetidine - Organic nitro compound - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Thioether - Hemithioaminal - Allyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Hydrocarbon derivative - Organooxygen compound - Organic salt - Organic zwitterion - Organic oxygen compound - Carbonyl group - Organic oxide - Organic nitrogen compound - 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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