Compound Identification
SMILES
CC(N)=[NH+]CCSCC1=C(SC2=C(N3[C@H](SC2)[C@H](NC(=O)C(=N/O)\C2=C(Cl)SC(N)=N2)C3=O)C([O-])=O)C=CN=C1
InChIKey
InChIKey=LGOYAIYJZKFDBR-CLDIZIQQSA-N
Formula
C22H23ClN8O5S4
Mass
643.17
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
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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 2,4,5-trisubstituted thiazoles Aryl thioethers Vinylogous thioesters 1,3-thiazines Pyridines and derivatives 2-amino-1,3-thiazoles Aryl chlorides Ketoximes Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids Azetidines Carboxylic acid salts Secondary carboxylic acid amides Tertiary amines Thioenol ethers Thiohemiaminal derivatives Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxamidines Carboximidamides Carboxylic acids Monocarboxylic acids and derivatives Dialkylthioethers Organochlorides Organic zwitterions Organic oxides Primary amines Organic salts Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - 2,4,5-trisubstituted 1,3-thiazole - Meta-thiazine - Aryl chloride - 1,3-thiazol-2-amine - Vinylogous thioester - Aryl halide - Pyridine - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Azole - Ketoxime - Carboxylic acid salt - Carboxamide group - Azetidine - Thioenolether - Amino acid or derivatives - Amino acid - Tertiary amine - Secondary carboxylic acid amide - Amidine - Azacycle - Dialkylthioether - Organic 1,3-dipolar compound - Carboxylic acid amidine - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Monocarboxylic acid or derivatives - Carboximidamide - Hemithioaminal - Thioether - Hydrocarbon derivative - Organic zwitterion - Organic oxygen compound - Organic salt - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Primary amine - Amine - 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