Compound Identification
SMILES
CC[N+](C)(C\C=C\C1=C(N2C(SC1)C(NC(=O)CC1=CC=CC=C1)C2=O)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1)CC(N)=O
InChIKey
InChIKey=INKCCQMQQMQYMF-DEDYPNTBSA-O
Formula
C36H39N4O5S
Mass
639.79
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
Diphenylmethanes N-acyl-alpha amino acids and derivatives Alpha amino acid amides Benzyloxycarbonyls Phenylacetamides 1,3-thiazines Tertiary carboxylic acid amides Enoate esters Tetraalkylammonium salts Azetidines Primary carboxylic acid amides Secondary carboxylic acid amides Thiohemiaminal derivatives Monocarboxylic acids and derivatives Dialkylthioethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - Diphenylmethane - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Phenylacetamide - Meta-thiazine - Monocyclic benzene moiety - Benzenoid - Tetraalkylammonium salt - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Quaternary ammonium salt - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid ester - Primary carboxylic acid amide - Secondary carboxylic acid amide - Hemithioaminal - Monocarboxylic acid or derivatives - Dialkylthioether - Carboxylic acid derivative - Azacycle - Thioether - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Amine - 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