Compound Identification
SMILES
CN(C)C(=O)C1=CC(=O)C(O)=CN1CC[N+](C)(C)CC1=C(N2[C@@H](SC1)[C@H](NC(=O)C(=N\OC(C)(C)C(O)=O)\C1=NSC(N)=N1)C2=O)C(O)=O
InChIKey
InChIKey=ZEJZLUWAIRFSDZ-LTMXGVCASA-O
Formula
C28H36N9O10S2
Mass
722.77
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
N-acyl-alpha amino acids and derivatives Pyridinecarboxylic acids and derivatives 2-heteroaryl carboxamides Dihydropyridines Hydroxypyridines 1,3-thiazines Dicarboxylic acids and derivatives Vinylogous amides Thiadiazoles Tetraalkylammonium salts Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Azetidines Cyclic ketones Dialkylthioethers Azacyclic compounds Carboxylic acids Thiohemiaminal derivatives Primary amines Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3'-quaternary ammonium cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Hydroxypyridine - Dihydropyridine - Meta-thiazine - Pyridine - Hydropyridine - Dicarboxylic acid or derivatives - Tetraalkylammonium salt - Quaternary ammonium salt - Tertiary carboxylic acid amide - Thiadiazole - Heteroaromatic compound - Azole - Vinylogous amide - Azetidine - Secondary carboxylic acid amide - Cyclic ketone - Amino acid - Carboxamide group - Amino acid or derivatives - Azacycle - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Hemithioaminal - Thioether - Organic oxide - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organooxygen compound - 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