Compound Identification
SMILES
CO\N=C(/C(=O)N[C@H]1C2SCC(C[N+]3=CC=CC(=C3)C3=C(F)C=C(C=C3)N3C[C@H](CNC(C)=O)OC3=O)=C(N2C1=O)C([O-])=O)C1=CSC(N)=N1
InChIKey
InChIKey=UOQGWQUZUXYEGH-PJKFMGIMSA-N
Formula
C31H29FN8O8S2
Mass
724.74
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 Phenylpyridines Fluorobenzenes 2,4-disubstituted thiazoles Oxazolidinones 2-amino-1,3-thiazoles Aryl fluorides 1,3-thiazines Pyridinium derivatives Heteroaromatic compounds Tertiary carboxylic acid amides Acetamides Carbamate esters Amino acids Azetidines Carboxylic acid salts Secondary carboxylic acid amides Thiohemiaminal derivatives Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylthioethers Primary amines Organic oxides Organofluorides Carbonyl compounds Hydrocarbon derivatives Organic zwitterions Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - 3-phenylpyridine - Alpha-amino acid or derivatives - 2,4-disubstituted 1,3-thiazole - Fluorobenzene - Halobenzene - Meta-thiazine - Aryl fluoride - Aryl halide - Pyridine - Monocyclic benzene moiety - 1,3-thiazol-2-amine - Pyridinium - Benzenoid - Oxazolidinone - Oxazolidine - Thiazole - Tertiary carboxylic acid amide - Carbamic acid ester - Acetamide - Azole - Heteroaromatic compound - Amino acid or derivatives - Amino acid - Azetidine - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Thioether - Hemithioaminal - Monocarboxylic acid or derivatives - Oxacycle - Dialkylthioether - Azacycle - Carboxylic acid - Carboxylic acid derivative - Primary amine - Organic nitrogen compound - Amine - Carbonyl group - Organic salt - Organic zwitterion - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organohalogen 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