Compound Identification
SMILES
CCN1C=C(C(O)=O)C(=O)C2=CC(F)=C(C=C12)N1CC[N+](C)(CC2=C(N3[C@H](SC2)[C@H](NC(=O)C(=N/OC)\C2=CSC(N)=N2)C3=O)C(O)=O)CC1
InChIKey
InChIKey=BNFYMTGZLROCBA-DZBKVFFFSA-O
Formula
C31H34FN8O8S2
Mass
729.78
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Cephems
- Level 6 Cephalosporins
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Level 5
Cephems
-
Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Cephems - Cephalosporins
Direct Parent
3'-quaternary ammonium cephalosporins
Alternative Parents
Quinoline carboxylic acids N-acyl-alpha amino acids and derivatives Fluoroquinolones N-arylpiperazines Aminoquinolines and derivatives Haloquinolines Hydroquinolones Hydroquinolines Pyridinecarboxylic acids Dialkylarylamines 2,4-disubstituted thiazoles N-methylpiperazines 1,3-thiazines 2-amino-1,3-thiazoles Aryl fluorides Benzenoids Vinylogous amides Heteroaromatic compounds Tertiary carboxylic acid amides Tetraalkylammonium salts Azetidines Secondary carboxylic acid amides Amino acids Monocarboxylic acids and derivatives Thiohemiaminal derivatives Azacyclic compounds Dialkylthioethers Carboxylic acids Primary amines Hydrocarbon derivatives Organofluorides Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3'-quaternary ammonium cephalosporin - Quinoline-3-carboxylic acid - N-acyl-alpha amino acid or derivatives - Fluoroquinolone - N-arylpiperazine - Haloquinoline - Aminoquinoline - Dihydroquinolone - Dihydroquinoline - Quinoline - Alpha-amino acid or derivatives - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Dialkylarylamine - N-alkylpiperazine - N-methylpiperazine - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - Aryl fluoride - Aryl halide - 1,4-diazinane - Piperazine - 1,3-thiazol-2-amine - Pyridine - Benzenoid - Tetraalkylammonium salt - Vinylogous amide - Quaternary ammonium salt - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Carboxamide group - Amino acid - Azetidine - Secondary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Monocarboxylic acid or derivatives - Thioether - Carboxylic acid derivative - Dialkylthioether - Carboxylic acid - Azacycle - Hemithioaminal - Organic nitrogen compound - Organic oxide - Amine - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary amine - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3'-quaternary ammonium cephalosporins. These are cephalosporins that are substituted at the 3'-position by a quaternary ammonium group.
External Descriptors
Not available