Compound Identification
SMILES
CO\N=C(/C(=O)N[C@H]1[C@H]2SCC(C[N+]3(C)C[C@H](O)C[C@H]3CO)=C(N2C1=O)C(O)=O)C1=NSC(N)=N1
InChIKey
InChIKey=CGMVVJMNXAXRSO-AMQPTFDDSA-O
Formula
C19H26N7O7S2
Mass
528.58
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 N-alkylpyrrolidines 1,3-thiazines Heteroaromatic compounds Thiadiazoles Tetraalkylammonium salts Tertiary carboxylic acid amides Azetidines Secondary carboxylic acid amides Secondary alcohols Amino acids 1,2-aminoalcohols Dialkylthioethers Thiohemiaminal derivatives Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Primary amines Carbonyl compounds Hydrocarbon derivatives Organic oxides Primary alcohols Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3'-quaternary ammonium cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Meta-thiazine - N-alkylpyrrolidine - Tetraalkylammonium salt - Azole - Pyrrolidine - Heteroaromatic compound - Quaternary ammonium salt - Tertiary carboxylic acid amide - Thiadiazole - 1,2-aminoalcohol - Carboxamide group - Amino acid - Amino acid or derivatives - Secondary alcohol - Secondary carboxylic acid amide - Azetidine - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Dialkylthioether - Carboxylic acid derivative - Thioether - Hemithioaminal - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Carbonyl group - Primary amine - Hydrocarbon derivative - Amine - Organic oxide - Alcohol - 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