Compound Identification
SMILES
COP(=O)(OC)\C=C(/C(=O)N[C@H]1[C@H]2SCC(CCSC3=NC(N)=C(C)C(N)=[N+]3N)=C(N2C1=O)C([O-])=O)C1=CSC(N)=N1
InChIKey
InChIKey=QHGSBGBQRADGGU-YGJRYDOWSA-N
Formula
C22H28N9O7PS3
Mass
657.68
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
Direct Parent
Cephalosporins
Alternative Parents
N-acyl-alpha amino acids and derivatives 2,4-disubstituted thiazoles Alkylarylthioethers Aminopyrimidines and derivatives Phosphonic acid diesters 1,3-thiazines 2-amino-1,3-thiazoles Imidolactams Phosphonic acid esters Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids Azetidines Carboxylic acid salts Secondary carboxylic acid amides Dialkylthioethers Carboxylic acids Azacyclic compounds Sulfenyl compounds Thiohemiaminal derivatives Monocarboxylic acids and derivatives Organic oxides Organophosphorus compounds Carbonyl compounds Primary amines Organic salts Hydrocarbon derivatives Organic zwitterions
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 - Alkylarylthioether - Aminopyrimidine - Phosphonic acid diester - Pyrimidine - Meta-thiazine - Phosphonic acid ester - Imidolactam - 1,3-thiazol-2-amine - Organophosphonic acid derivative - Azole - Thiazole - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Azetidine - Amino acid or derivatives - Amino acid - Thioether - Carboxylic acid derivative - Hemithioaminal - Carboxylic acid - Sulfenyl compound - Dialkylthioether - Monocarboxylic acid or derivatives - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organophosphorus compound - Organosulfur compound - Carbonyl group - Primary amine - Organic zwitterion - Organic salt - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen 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