Compound Identification
SMILES
[Cl-].C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(CN3N=C(C4=CC=CC=C4)C4=C(C=C(CC[N+]56CC[N+](CCCO)(CC5)CC6)C=C4)S3(=O)=O)=C(N2C1=O)C([O-])=O
InChIKey
InChIKey=NQKCKEWSWZUKTI-YZYDDXTRSA-M
Formula
C35H44ClN5O7S
Mass
714.28
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
- Level 5 Carbapenems
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Subclass
Beta lactams
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Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Not available
Direct Parent
Carbapenems
Alternative Parents
Alpha amino acids and derivatives Phenethylamines Pyrroline carboxylic acids Aralkylamines Azepines N-alkylpiperazines Organosulfonic acids and derivatives 1,3-aminoalcohols Tetraalkylammonium salts Tertiary carboxylic acid amides Carboxylic acid salts Azetidines Secondary alcohols Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic zwitterions Organic oxides Organic chloride salts Hydrocarbon derivatives Carbonyl compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbapenem - Alpha-amino acid or derivatives - Phenethylamine - Pyrroline carboxylic acid or derivatives - Pyrroline carboxylic acid - N-alkylpiperazine - Azepine - Aralkylamine - 1,4-diazinane - Piperazine - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tetraalkylammonium salt - Pyrroline - Quaternary ammonium salt - 1,3-aminoalcohol - Carboxylic acid salt - Azetidine - Carboxamide group - Secondary alcohol - Carboxylic acid derivative - Azacycle - Alkanolamine - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Carbonyl group - Organic zwitterion - Organic salt - Organic chloride salt - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as carbapenems. These are beta-lactam derivatives in which the beta-lactam ring shares the nitrogen atom with a pyrrole-2-carboxylic acid.
External Descriptors
Not available