Compound Identification
SMILES
NC(=O)COC1=CC=CC2=C1C=C[N+](CC1=C(N3[C@H](SC1)[C@H](NC(=O)CSC1=C(Cl)C=CC(Cl)=C1)C3=O)C([O-])=O)=C2
InChIKey
InChIKey=ANHUHBWCPSXVAG-ZEQKJWHPSA-N
Formula
C27H22Cl2N4O6S2
Mass
633.52
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 Isoquinolines and derivatives Dichlorobenzenes Thiophenol ethers Phenol ethers Alkylarylthioethers Alkyl aryl ethers Pyridinium derivatives Aryl chlorides 1,3-thiazines Heteroaromatic compounds Tertiary carboxylic acid amides Secondary carboxylic acid amides Primary carboxylic acid amides Amino acids Azetidines Carboxylic acid salts Tertiary amines Thiohemiaminal derivatives Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylthioethers Organic oxides Carbonyl compounds Organic zwitterions Organic salts Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Isoquinoline - Phenol ether - Aryl thioether - Thiophenol ether - 1,4-dichlorobenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl halide - Pyridine - Pyridinium - Monocyclic benzene moiety - Benzenoid - Meta-thiazine - Aryl chloride - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid - Amino acid or derivatives - Carboxylic acid salt - Carboxamide group - Azetidine - Tertiary amine - Primary carboxylic acid amide - Secondary carboxylic acid amide - Hemithioaminal - Carboxylic acid - Carboxylic acid derivative - Azacycle - Thioether - Ether - Dialkylthioether - Sulfenyl compound - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Amine - Organic oxide - 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