Compound Identification
SMILES
CSC1=C[N+](CC2=C(N3[C@@H](SC2)[C@H](NC(=O)C(=N/O[C@H]2CCNC2=O)\C2=CSC(N)=N2)C3=O)C([O-])=O)=CC=C1
InChIKey
InChIKey=DDCHCXDSIILTJO-FUPVXKIFSA-N
Formula
C23H23N7O6S3
Mass
589.66
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 Alkylarylthioethers 2,4-disubstituted thiazoles 2-amino-1,3-thiazoles 1,3-thiazines Pyridinium derivatives Pyrrolidine-2-ones Tertiary carboxylic acid amides Heteroaromatic compounds Azetidines Amino acids Carboxylic acid salts Secondary carboxylic acid amides Sulfenyl compounds Thiohemiaminal derivatives Monocarboxylic acids and derivatives Dialkylthioethers Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Meta-thiazine - Pyridine - Pyridinium - 1,3-thiazol-2-amine - Pyrrolidone - 2-pyrrolidone - Azole - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Thiazole - Amino acid or derivatives - Azetidine - Carboxamide group - Carboxylic acid salt - Amino acid - Secondary carboxylic acid amide - Dialkylthioether - Azacycle - Sulfenyl compound - Hemithioaminal - Carboxylic acid derivative - Thioether - Carboxylic acid - Monocarboxylic acid or derivatives - Amine - Organic oxide - Organic salt - Carbonyl group - Organic zwitterion - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - 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