Compound Identification
SMILES
CON=C(C(=O)N[C@H]1[C@@H]2SCC(C[NH+]3CCC[C@@]3(C)CO)=C(N2C1=O)C(O)=O)C1=NSC(N)=N1
InChIKey
InChIKey=NNROBUBZEYZHQZ-DQNAHFDYSA-O
Formula
C19H26N7O6S2
Mass
512.58
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
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Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Cephems
Direct Parent
Cephalosporins
Alternative Parents
N-acyl-alpha amino acids and derivatives N-alkylpyrrolidines 1,3-thiazines Heteroaromatic compounds Thiadiazoles Tertiary carboxylic acid amides Quaternary ammonium salts Trialkylamines Azetidines Secondary carboxylic acid amides Amino acids 1,2-aminoalcohols Thiohemiaminal derivatives Carboxylic acids Azacyclic compounds Dialkylthioethers Monocarboxylic acids and derivatives Primary amines Carbonyl compounds Hydrocarbon derivatives Organic oxides Primary alcohols Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - N-alkylpyrrolidine - Meta-thiazine - Pyrrolidine - Quaternary ammonium salt - Tertiary carboxylic acid amide - Thiadiazole - Azole - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Tertiary aliphatic amine - 1,2-aminoalcohol - Azetidine - Amino acid - Amino acid or derivatives - Tertiary amine - Thioether - Hemithioaminal - Carboxylic acid derivative - Carboxylic acid - Dialkylthioether - Monocarboxylic acid or derivatives - Azacycle - 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 cephalosporins. These are compounds containing a 1,2-thiazine fused to a 2-azetidinone to for a oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid moiety or a derivative thereof.
External Descriptors
Not available