Compound Identification
SMILES
CO\N=C(/C(=O)NC1C2SCC(SC3=NC4=CC=CC=C4S3)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1
InChIKey
InChIKey=VSNXTWBLHMYDQW-ROTLSHHCSA-N
Formula
C20H16N6O5S4
Mass
548.63
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Lactams
-
Subclass
Beta lactams
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Level 5
Cephems
- Level 6 Cephalosporins
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Level 5
Cephems
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Subclass
Beta lactams
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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 Benzothiazoles Aryl thioethers 2,4-disubstituted thiazoles Vinylogous thioesters 1,3-thiazines 2-amino-1,3-thiazoles Benzenoids Tertiary carboxylic acid amides Heteroaromatic compounds Thioenol ethers Amino acids Secondary carboxylic acid amides Azetidines Thiohemiaminal derivatives Azacyclic compounds Sulfenyl compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - 1,3-benzothiazole - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - Benzenoid - 1,3-thiazol-2-amine - Vinylogous thioester - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - Thiazole - Thioenolether - Amino acid - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Amino acid or derivatives - Thioether - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Hemithioaminal - Sulfenyl compound - Azacycle - Dialkylthioether - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Primary amine - Hydrocarbon derivative - Amine - 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