Compound Identification
SMILES
OC(=O)C1=C(C[N+]2=CC3=CC=CC=C3C=C2)CS[C@@H]2[C@H](NC(=O)CSC3=C(Cl)C=CC(Cl)=C3)C(=O)N12
InChIKey
InChIKey=DIWPMXGOFMMDHK-ZJSXRUAMSA-O
Formula
C25H20Cl2N3O4S2
Mass
561.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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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 Isoquinolines and derivatives Thiophenol ethers Dichlorobenzenes Alkylarylthioethers 1,3-thiazines Aryl chlorides Pyridinium derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Azetidines Tertiary amines Thiohemiaminal derivatives Azacyclic compounds Sulfenyl compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Organochlorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Isoquinoline - Thiophenol ether - Aryl thioether - 1,4-dichlorobenzene - Chlorobenzene - Alkylarylthioether - Halobenzene - Benzenoid - Aryl halide - Pyridinium - Meta-thiazine - Aryl chloride - Pyridine - Monocyclic benzene moiety - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid - Azetidine - Carboxamide group - Amino acid or derivatives - Secondary carboxylic acid amide - Tertiary amine - Thioether - Hemithioaminal - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Monocarboxylic acid or derivatives - Dialkylthioether - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Amine - 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