Compound Identification
SMILES
CNCCNC1=CC2=C(N1)C=CC=[N+]2CC1=C(N2C(SC1)[C@H](NC(=O)C(=NO[C@@H](C)C(O)=O)C1=C(Cl)SC(N)=N1)C2=O)C(O)=O
InChIKey
InChIKey=MJVGIERXQGJVPT-PAJKBXIISA-O
Formula
C26H29ClN9O7S2
Mass
679.14
Taxonomic Classification
Taxonomy Tree
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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 Pyrrolopyridines 2,4,5-trisubstituted thiazoles 1,3-thiazines Substituted pyrroles Pyridinium derivatives 2-amino-1,3-thiazoles Aryl chlorides Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Azetidines Dialkylthioethers Dialkylamines Carboxylic acids Azacyclic compounds Thiohemiaminal derivatives Carbonyl compounds Primary amines Organochlorides Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Pyrrolopyridine - 2,4,5-trisubstituted 1,3-thiazole - Meta-thiazine - Dicarboxylic acid or derivatives - Pyridine - Pyridinium - Substituted pyrrole - Aryl halide - 1,3-thiazol-2-amine - Aryl chloride - Tertiary carboxylic acid amide - Pyrrole - Thiazole - Azole - Heteroaromatic compound - Carboxamide group - Azetidine - Amino acid - Amino acid or derivatives - Secondary carboxylic acid amide - Azacycle - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Secondary amine - Secondary aliphatic amine - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Primary amine - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - 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