Compound Identification
SMILES
CC(O\N=C(/C(=O)NC1C2SCC([C@@H]3CC[N+](C)(C)O3)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1)C(O)=O
InChIKey
InChIKey=FUACJHZQCMKQPK-TUVDEMRFSA-O
Formula
C20H25N6O8S2
Mass
541.57
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 2,4-disubstituted thiazoles Dicarboxylic acids and derivatives 2-amino-1,3-thiazoles 1,3-thiazines Tertiary carboxylic acid amides Isoxazolidines Heteroaromatic compounds Amino acids Azetidines Secondary carboxylic acid amides Azacyclic compounds N-organohydroxylamines Thiohemiaminal derivatives Dialkylthioethers Oxacyclic compounds Carboxylic acids Primary amines Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - 1,3-thiazol-2-amine - Dicarboxylic acid or derivatives - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Azole - Isoxazolidine - Carboxamide group - Azetidine - Amino acid or derivatives - Amino acid - Secondary carboxylic acid amide - Oxacycle - Azacycle - N-organohydroxylamine - Carboxylic acid derivative - Carboxylic acid - Dialkylthioether - Hemithioaminal - Thioether - Amine - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary amine - 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