Structure Information
Structure

Compound Identification

SMILES

[Na+].CC1(C)S[C@@H]2[C@H](NC(=O)C(N)C3=CC=CC=C3)C(=O)N2[C@H]1C(O)=O.CCOC(=O)C1=CN(C[C@@]2(C)[C@@H](C3C(CC3=O)S2(=O)=O)C([O-])=O)N=N1

InChIKey

InChIKey=CHVIFUSGEFUOTN-AMLCTOQYSA-M

Formula

C30H35N6NaO11S2

Mass

742.75

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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 - Thiepane - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Sulfone - Tertiary carboxylic acid amide - Azole - Vinylogous amide - Thiazolidine - 1,2,3-triazole - Thiolane - Heteroaromatic compound - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Carboxylic acid ester - Carboxylic acid salt - Ketone - Secondary carboxylic acid amide - Tertiary amine - Hemithioaminal - Azacycle - Thioether - Dialkylthioether - Organic alkali metal salt - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Organic zwitterion - Organic oxide - Organic oxygen compound - Primary aliphatic amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic sodium salt - Organic salt - Organonitrogen compound - Organooxygen compound - Primary amine - 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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