Compound Identification
SMILES
CCCC[N+]1=C(N)C=C(N)N=C1SCC1=C(N2[C@@H](SC1)[C@H](NC(=O)C(=N/OC(C)(C)C(O)=O)\C1=NSC(N)=N1)C2=O)C(O)=O
InChIKey
InChIKey=BRLBUYDHOIGVTD-KKOAZRMTSA-O
Formula
C24H31N10O7S3
Mass
667.75
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 Aminopyrimidines and derivatives Alkylarylthioethers Dicarboxylic acids and derivatives Imidolactams 1,3-thiazines Tertiary carboxylic acid amides Thiadiazoles Heteroaromatic compounds Amino acids Azetidines Secondary carboxylic acid amides Azacyclic compounds Thiohemiaminal derivatives Dialkylthioethers Carboxylic acids Sulfenyl compounds 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 - Aryl thioether - Aminopyrimidine - Alkylarylthioether - Meta-thiazine - Dicarboxylic acid or derivatives - Pyrimidine - Imidolactam - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - Thiadiazole - Amino acid or derivatives - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Amino acid - Thioether - Dialkylthioether - Sulfenyl compound - Hemithioaminal - Azacycle - Carboxylic acid derivative - Carboxylic acid - Hydrocarbon derivative - Amine - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic oxygen 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