Compound Identification
SMILES
CCO\N=C(/C(=O)N[C@H]1[C@H]2SCC(\C=C\C3=N[N+]4=C(C=C3)N(C)C=C4)=C(N2C1=O)C([O-])=O)C1=NSC(N)=N1
InChIKey
InChIKey=GJSRHZINNDFPIS-JSAFAEBKSA-N
Formula
C22H21N9O5S2
Mass
555.59
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 1,3-thiazines Pyridazines and derivatives N-substituted imidazoles Thiadiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids Azetidines Carboxylic acid salts Secondary carboxylic acid amides Monocarboxylic acids and derivatives Thiohemiaminal derivatives Dialkylthioethers Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Primary amines Organic zwitterions Organic oxides Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Meta-thiazine - N-substituted imidazole - Pyridazine - Tertiary carboxylic acid amide - Heteroaromatic compound - Azole - Thiadiazole - Imidazole - Carboxylic acid salt - Carboxamide group - Azetidine - Secondary carboxylic acid amide - Amino acid - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Dialkylthioether - Carboxylic acid - Hemithioaminal - Monocarboxylic acid or derivatives - Thioether - Organic oxide - Amine - Organic oxygen compound - Organic salt - Carbonyl group - Organic zwitterion - Hydrocarbon derivative - Organic nitrogen compound - Primary amine - 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