Compound Identification
SMILES
CCON=C(C(=O)NC1[C@H]2N(C1=O)C(C(O)=O)=C(CS2=O)C=COS(=O)(=O)C1=CC=C(C)C=C1)C1=NSC(N)=N1
InChIKey
InChIKey=GTIAWJDMZVCWSF-WOXYIOCBSA-N
Formula
C22H22N6O9S3
Mass
610.63
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 p-Methylbenzenesulfonates Benzenesulfonate esters Tosyl compounds Arylsulfonic acids and derivatives Benzenesulfonyl compounds 1,3-thiazines Organosulfonic acid esters Sulfonyls Thiadiazoles Heteroaromatic compounds Tertiary carboxylic acid amides Tertiary amines Sulfoxides Azetidines Secondary carboxylic acid amides Amino acids Sulfinyl compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Primary amines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Benzenesulfonate ester - P-methylbenzenesulfonate - Alpha-amino acid or derivatives - Tosyl compound - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Toluene - Meta-thiazine - Monocyclic benzene moiety - Organosulfonic acid ester - Benzenoid - Azole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tertiary carboxylic acid amide - Thiadiazole - Amino acid or derivatives - Secondary carboxylic acid amide - Azetidine - Tertiary amine - Sulfoxide - Amino acid - Carboxamide group - Sulfinyl compound - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Primary amine - 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