Structure Information
Structure

Compound Identification

SMILES

N[C@@H](CCC(N)=O)C(O)=O.CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)C3=CC=CC=C3)C(=O)N2[C@H]1C(O)=O

InChIKey

InChIKey=HSVSQGPJDUWRKP-QPURXXKLSA-N

Formula

C21H29N5O7S

Mass

495.55

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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

Not available

Substituents

Penicillin - Glutamine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - Phenylacetamide - Aralkylamine - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Fatty acid - Benzenoid - Tertiary carboxylic acid amide - Thiazolidine - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Primary carboxylic acid amide - Secondary carboxylic acid amide - Tertiary amine - Thioether - Hemithioaminal - Azacycle - Monocarboxylic acid or derivatives - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Organooxygen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Primary aliphatic amine - Primary amine - Organic nitrogen compound - Organic oxygen 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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