Structure Information
Structure

Compound Identification

SMILES

C[C@]1(CN2C=CN=N2)[C@@H](C2C(CC2=O)S1(=O)=O)C(O)=O.CC1(C)S[C@@H]2[C@H](NC(=O)C(N)C3=CC=CC=C3)C(=O)N2[C@H]1C(O)=O

InChIKey

InChIKey=QUKAVEWWYOXFAU-ZSFRYTKVSA-N

Formula

C27H32N6O9S2

Mass

648.71

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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 - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Phenylacetamide - Aralkylamine - Thiepane - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Sulfone - 1,2,3-triazole - Thiolane - Tertiary carboxylic acid amide - Thiazolidine - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Ketone - Secondary carboxylic acid amide - Tertiary amine - Thioether - Hemithioaminal - Dialkylthioether - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Primary aliphatic amine - Primary amine - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - 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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