Compound Identification
SMILES
CN1[C@@H](N)C=C(N=C1N)C1=C(N2[C@H](SC1)[C@](NC(=O)C(=N/OCCC(O)=O)\C1=CSC(N)=N1)(C=S)C2=O)C(O)=O
InChIKey
InChIKey=QZBYYXOAHLUPHY-IJZFDLKXSA-N
Formula
C21H23N9O7S3
Mass
609.65
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 Aminopyrimidines and derivatives 1,3-thiazines 2-amino-1,3-thiazoles Dicarboxylic acids and derivatives Hydropyrimidines Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Azetidines Guanidines Dialkylthioethers Carboxylic acids Carboximidamides Thiohemiaminal derivatives Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Thioaldehydes Carbonyl compounds Primary amines Organic oxides Hydrocarbon derivatives
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 - Aminopyrimidine - Meta-thiazine - 1,6-dihydropyrimidine - Hydropyrimidine - 1,3-thiazol-2-amine - Dicarboxylic acid or derivatives - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Azole - Amino acid - Amino acid or derivatives - Guanidine - Azetidine - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Carboximidamide - Hemithioaminal - Thioether - Thioaldehyde - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Thiocarbonyl group - Carbonyl group - Primary amine - Organonitrogen compound - Organooxygen compound - Organosulfur 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