Compound Identification
SMILES
OC(C(=O)NC1[C@@H]2SCC(C(CC(O)=O)SC3=NNN=N3)=C(N2C1=O)C(O)=O)C1=CC(=CC=C1)[N+]([O-])=O
InChIKey
InChIKey=XPPUWQULDPFHSE-JQJNJVKFSA-N
Formula
C19H17N7O9S2
Mass
551.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
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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 Phenylacetamides Nitrobenzenes Nitroaromatic compounds Thia fatty acids Alkylarylthioethers Hydroxy fatty acids 1,3-thiazines Dicarboxylic acids and derivatives Tetrazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Secondary alcohols Azetidines Thiohemiaminal derivatives Sulfenyl compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Dialkylthioethers Organic oxoazanium compounds Carbonyl compounds Organonitrogen compounds Organic zwitterions Hydrocarbon derivatives Organic salts Aromatic alcohols Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Phenylacetamide - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Hydroxy fatty acid - Alkylarylthioether - Thia fatty acid - Meta-thiazine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Fatty acyl - Benzenoid - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Tetrazole - Azetidine - Carboxamide group - Organic nitro compound - C-nitro compound - Secondary alcohol - Secondary carboxylic acid amide - Sulfenyl compound - Hemithioaminal - Allyl-type 1,3-dipolar organic compound - Thioether - Dialkylthioether - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Carboxylic acid derivative - Organic 1,3-dipolar compound - Carboxylic acid - Azacycle - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Organic zwitterion - Organic salt - Organonitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Aromatic alcohol - 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