Compound Identification
SMILES
CO\N=C(\C(=O)N[C@H]1C2SCC(SC3=NC(=NS3)[N+]3=CC=C(C=C3)C(N)=O)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1
InChIKey
InChIKey=KKNGMZWMZWTAEC-UQUZDUKDSA-O
Formula
C21H18N9O6S4
Mass
620.67
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 Pyridinecarboxylic acids and derivatives Aryl thioethers 2,4-disubstituted thiazoles 1,3-thiazines Vinylogous thioesters 2-amino-1,3-thiazoles Pyridinium derivatives Thiadiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Primary carboxylic acid amides Secondary carboxylic acid amides Amino acids Thioenol ethers Azetidines Sulfenyl compounds Thiohemiaminal derivatives Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylthioethers Carbonyl compounds Primary amines Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Pyridine carboxylic acid or derivatives - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - Pyridine - Pyridinium - 1,3-thiazol-2-amine - Vinylogous thioester - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiadiazole - Thiazole - Azole - Secondary carboxylic acid amide - Amino acid - Thioenolether - Primary carboxylic acid amide - Azetidine - Amino acid or derivatives - Carboxamide group - Azacycle - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Monocarboxylic acid or derivatives - Hemithioaminal - Thioether - Amine - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Organic oxygen compound - Organic cation - 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