Structure Information
Structure

Compound Identification

SMILES

C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(S[C@H]3C[C@H](N(C)C3)C(=O)N3CC[C@@H](C3)NC(=O)CN=C(NC(=O)OCC3=CC=C(C=C3)[N+]([O-])=O)NC(=O)OCC3=CC=C(C=C3)[N+]([O-])=O)=C(N2C1=O)C(=O)OCC1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=KBBBUOCOQYSZHB-DQTMYKTNSA-N

Formula

C46H50N10O16S

Mass

1031.02

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Carbapenems

Direct Parent

Thienamycins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Thienamycin - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Nitrobenzene - Nitroaromatic compound - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Monocyclic benzene moiety - Vinylogous thioester - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Alpha,beta-unsaturated carboxylic ester - Pyrroline - Tertiary carboxylic acid amide - Carbamic acid ester - Enoate ester - Thioenolether - Carboxylic acid ester - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Guanidine - Amino acid or derivatives - Organic nitro compound - Tertiary aliphatic amine - C-nitro compound - Carboxamide group - Azetidine - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Carboximidamide - Sulfenyl compound - Organic zwitterion - Organic salt - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organosulfur compound - Organic oxide - Alcohol - Organic nitrogen compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thienamycins. These are beta-lactam antibiotics that differ from penicillins in having the thiazolidine sulfur atom replaced by carbon, the sulfur then becoming the first atom in the side chain.

External Descriptors

Not available

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