Compound Identification
SMILES
CC1=NC(CC(=O)NC2C3SCC(CSC4=NN=C(C)S4)=C(N3C2=O)C(O)=O)=NO1
InChIKey
InChIKey=ZNLPLKVYARXNLS-UHFFFAOYSA-N
Formula
C16H16N6O5S3
Mass
468.52
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 Alkylarylthioethers 1,3-thiazines 1,2,4-oxadiazoles Thiadiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Amino acids Azetidines Secondary carboxylic acid amides Thiohemiaminal derivatives Dialkylthioethers Carboxylic acids Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - Alkylarylthioether - Meta-thiazine - 1,2,4-oxadiazole - Azole - Oxadiazole - Tertiary carboxylic acid amide - Thiadiazole - Heteroaromatic compound - Amino acid or derivatives - Tertiary amine - Secondary carboxylic acid amide - Azetidine - Amino acid - Carboxamide group - Hemithioaminal - Thioether - Oxacycle - Azacycle - Dialkylthioether - Sulfenyl compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Amine - Organic oxide - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - 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