Compound Identification
SMILES
NC1=NC(=CS1)C(=N\OCC(O)=O)\C(=O)N[C@@H]1[C@H]2SCC(CSC3=[N+](N)C=CC(N)=N3)=C(N2C1=O)C([O-])=O
InChIKey
InChIKey=VAOHHWLYMYTBJL-WJQIEWPESA-N
Formula
C19H19N9O7S3
Mass
581.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Cephems
- Level 6 Cephalosporins
-
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
Direct Parent
Cephalosporins
Alternative Parents
N-acyl-alpha amino acids and derivatives 2,4-disubstituted thiazoles Alkylarylthioethers Aminopyrimidines and derivatives 1,3-thiazines 2-amino-1,3-thiazoles Imidolactams Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Azetidines Carboxylic acid salts Thiohemiaminal derivatives Sulfenyl compounds Azacyclic compounds Dialkylthioethers Carboxylic acids Organic oxides Primary amines Hydrocarbon derivatives Carbonyl compounds Organic zwitterions Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Aminopyrimidine - Alkylarylthioether - Meta-thiazine - 1,3-thiazol-2-amine - Imidolactam - Dicarboxylic acid or derivatives - Pyrimidine - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Amino acid or derivatives - Amino acid - Azetidine - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Thioether - Hemithioaminal - Sulfenyl compound - Dialkylthioether - Carboxylic acid derivative - Azacycle - Carboxylic acid - Organosulfur compound - Organic nitrogen compound - Organic salt - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Primary amine - Organic zwitterion - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - 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