Compound Identification
SMILES
CCOC(=O)N1CCN(CC1)C(\N)=N\N=CC1=C(N2[C@H](SC1)[C@H](NC(=O)C(=NO)C1=CSC(N)=N1)C2=O)C(O)=O
InChIKey
InChIKey=WKDISHCNIXFRLG-CXAGYDPISA-N
Formula
C21H26N10O7S2
Mass
594.62
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 Piperazine carboxylic acids 2,4-disubstituted thiazoles 1,3-thiazines 2-amino-1,3-thiazoles Tertiary carboxylic acid amides Carbamate esters Heteroaromatic compounds Ketoximes Secondary carboxylic acid amides Amino acids Azetidines Guanidines Carboxylic acids Azacyclic compounds Dialkylthioethers Thiohemiaminal derivatives Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Piperazine-1-carboxylic acid - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - 1,4-diazinane - 1,3-thiazol-2-amine - Piperazine - Azole - Heteroaromatic compound - Ketoxime - Tertiary carboxylic acid amide - Thiazole - Carbamic acid ester - Amino acid or derivatives - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Amino acid - Guanidine - Hemithioaminal - Thioether - Dialkylthioether - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Organic nitrogen compound - Amine - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Primary amine - Organic oxygen 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