Compound Identification
SMILES
OC(=O)C1=C(COC2=CC=C(CCl)C=C2)CSC2C(NC(=O)CC3=CC=CC=C3)C(=O)N12
InChIKey
InChIKey=RTBGTIKLPNAZBQ-UHFFFAOYSA-N
Formula
C23H21ClN2O5S
Mass
472.94
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 Phenylacetamides Benzyl chlorides Phenoxy compounds Phenol ethers Alkyl aryl ethers 1,3-thiazines Tertiary carboxylic acid amides Tertiary amines Amino acids Azetidines Secondary carboxylic acid amides Dialkylthioethers Carboxylic acids Thiohemiaminal derivatives Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Alkyl chlorides Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Phenylacetamide - Phenoxy compound - Benzyl halide - Benzyl chloride - Phenol ether - Alkyl aryl ether - Meta-thiazine - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Amino acid - Amino acid or derivatives - Carboxamide group - Azetidine - Secondary carboxylic acid amide - Tertiary amine - Azacycle - Ether - Monocarboxylic acid or derivatives - Dialkylthioether - Carboxylic acid - Carboxylic acid derivative - Hemithioaminal - Thioether - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Alkyl halide - Alkyl chloride - 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