Compound Identification
SMILES
CCOP(O)(=O)CC(SC1=NNN=N1)C1=C(N2[C@@H](SC1)[C@H](NC(=O)C(O)C1=CC=CC=C1)C2=O)C(O)=O
InChIKey
InChIKey=HITAKKNVTSJRNA-UXANZEMOSA-N
Formula
C20H23N6O8PS2
Mass
570.53
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 Phenylacetamides Alkylarylthioethers 1,3-thiazines Phosphonic acid esters Tetrazoles Tertiary carboxylic acid amides Heteroaromatic compounds Organic phosphonic acids Secondary carboxylic acid amides Secondary alcohols Azetidines Thiohemiaminal derivatives Sulfenyl compounds Azacyclic compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Aromatic alcohols Organophosphorus compounds Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Phenylacetamide - Aryl thioether - Alkylarylthioether - Meta-thiazine - Monocyclic benzene moiety - Phosphonic acid ester - Benzenoid - Heteroaromatic compound - Azole - Organophosphonic acid - Organophosphonic acid derivative - Tertiary carboxylic acid amide - Tetrazole - Azetidine - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Thioether - Dialkylthioether - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Hemithioaminal - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Organic oxide - Aromatic alcohol - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organophosphorus 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