Compound Identification
SMILES
C[C@@H]1S[C@H]2C(NC(=O)CC3=CC=CS3)C(=O)N2C(C(O)=O)=C1CSC1=NN=NN1CC(O)=O
InChIKey
InChIKey=RCQYFZUUVISNJK-LALGAEKQSA-N
Formula
C18H18N6O6S3
Mass
510.56
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 Dicarboxylic acids and derivatives 1,3-thiazines Thiophenes Tetrazoles Tertiary carboxylic acid amides Heteroaromatic compounds Azetidines Amino acids Tertiary amines Secondary carboxylic acid amides Dialkylthioethers Thiohemiaminal derivatives Azacyclic compounds Sulfenyl compounds Carboxylic acids 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 - Dicarboxylic acid or derivatives - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Tetrazole - Thiophene - Amino acid or derivatives - Azetidine - Carboxamide group - Amino acid - Secondary carboxylic acid amide - Tertiary amine - Hemithioaminal - Thioether - Sulfenyl compound - Azacycle - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Organosulfur compound - Organic nitrogen compound - Amine - Carbonyl group - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen 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