Compound Identification
SMILES
ClCC(=O)NC1=NC=C(S1)C1=C(N2C(C(NC(=O)CSC3=CC(Cl)=C(Cl)C=C3)C2=O)S(=O)C1)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=MQQOFYOMWTVZMC-UHFFFAOYSA-N
Formula
C33H25Cl3N4O6S3
Mass
776.12
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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 Diphenylmethanes Benzyloxycarbonyls Thiophenol ethers N-arylamides Dichlorobenzenes 2,5-disubstituted thiazoles Alkylarylthioethers 1,3-thiazines Aryl chlorides Tertiary carboxylic acid amides Chloroacetamides Heteroaromatic compounds Enoate esters Sulfoxides Secondary carboxylic acid amides Azetidines Azacyclic compounds Sulfinyl compounds Sulfenyl compounds Monocarboxylic acids and derivatives Carbonyl compounds Organochlorides Alkyl chlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - Diphenylmethane - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Aryl thioether - 1,2-dichlorobenzene - Thiophenol ether - N-arylamide - Chlorobenzene - 2,5-disubstituted 1,3-thiazole - Halobenzene - Alkylarylthioether - Benzenoid - Meta-thiazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Thiazole - Tertiary carboxylic acid amide - Chloroacetamide - Heteroaromatic compound - Azole - Carboxamide group - Sulfoxide - Carboxylic acid ester - Secondary carboxylic acid amide - Azetidine - Carboxylic acid derivative - Sulfinyl compound - Azacycle - Monocarboxylic acid or derivatives - Thioether - Sulfenyl compound - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl chloride - 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