Compound Identification
SMILES
CN1N=NN=C1SCC1=C(N2[C@@H](SC1)[C@H](NC(=O)C(Cl)(C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=C(O)C=C1)C2=O)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=CYUXSXNKJDELRS-DEDIEVFBSA-N
Formula
C45H37ClN6O7S2
Mass
873.4
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 Diphenylmethanes Phenylacetamides Benzyloxycarbonyls 1-hydroxy-2-unsubstituted benzenoids Alkylarylthioethers 1,3-thiazines Dicarboxylic acids and derivatives Tetrazoles Tertiary carboxylic acid amides Alpha-halocarboxylic acid derivatives Heteroaromatic compounds Enoate esters Secondary carboxylic acid amides Azetidines Dialkylthioethers Sulfenyl compounds Azacyclic compounds Thiohemiaminal derivatives Carbonyl compounds Organochlorides Organonitrogen compounds Alkyl chlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Diphenylmethane - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Phenylacetamide - Aryl thioether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkylarylthioether - Meta-thiazine - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Azole - Heteroaromatic compound - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Tetrazole - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Azetidine - Thioether - Hemithioaminal - Sulfenyl compound - Dialkylthioether - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl chloride - 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