Compound Identification
SMILES
CC(C)(C)OC(=O)CON=C(C(=O)NC1[C@@H]2SCC=C(N2C1=O)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1)C1=CSC(NC=O)=N1
InChIKey
InChIKey=YKUGPIAPVKZUBR-QFCCLOIZSA-N
Formula
C32H31N5O8S2
Mass
677.75
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
Diphenylmethanes N-acyl-alpha amino acids and derivatives Benzyloxycarbonyls N-arylamides 2,4-disubstituted thiazoles 1,3-thiazines Dicarboxylic acids and derivatives Heteroaromatic compounds Enoate esters Tertiary carboxylic acid amides Secondary carboxylic acid amides Azetidines Dialkylthioethers Thiohemiaminal derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - Diphenylmethane - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - N-arylamide - 2,4-disubstituted 1,3-thiazole - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Meta-thiazine - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Thiazole - Tertiary carboxylic acid amide - Azole - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Azetidine - Secondary carboxylic acid amide - Thioether - Hemithioaminal - Carboxylic acid derivative - Dialkylthioether - Azacycle - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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