Compound Identification
SMILES
CCSC1=NC(C)=CC(SCSC2=C(N3C(SC2)C(NC(=O)CSC2=C(Cl)C=NC=C2Cl)C3=O)C(O)=O)=N1
InChIKey
InChIKey=NCSNDCGFZNTRTN-UHFFFAOYSA-N
Formula
C22H21Cl2N5O4S5
Mass
650.64
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
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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 Polyhalopyridines Alkylarylthioethers Vinylogous thioesters 1,3-thiazines Aryl chlorides Pyrimidines and pyrimidine derivatives Tertiary carboxylic acid amides Dithioacetals Heteroaromatic compounds Thioenol ethers Azetidines Secondary carboxylic acid amides Sulfenyl compounds Dialkylthioethers Carboxylic acids Thiohemiaminal derivatives Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - Polyhalopyridine - Alkylarylthioether - Meta-thiazine - Aryl chloride - Aryl halide - Pyridine - Pyrimidine - Vinylogous thioester - Tertiary carboxylic acid amide - Heteroaromatic compound - Thioacetal - Thioenolether - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Hemithioaminal - Thioether - Azacycle - Dialkylthioether - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organosulfur 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