Compound Identification
SMILES
CC(O\N=C(/C(=O)NC1[C@H]2SCC(C=C)=C(N2C1=O)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1)C1=C(Cl)SC(N)=N1)C(=O)OC(C)(C)C
InChIKey
InChIKey=HLXNMEMVEGJZEI-HAYQDNSNSA-N
Formula
C34H34ClN5O7S2
Mass
724.24
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
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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 Diphenylmethanes Benzyloxycarbonyls 2,4,5-trisubstituted thiazoles 1,3-thiazines 2-amino-1,3-thiazoles Aryl chlorides Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Enoate esters Secondary carboxylic acid amides Azetidines Thiohemiaminal derivatives Azacyclic compounds Dialkylthioethers Carbonyl compounds Organic oxides Organochlorides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - Diphenylmethane - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - 2,4,5-trisubstituted 1,3-thiazole - Meta-thiazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,3-thiazol-2-amine - Benzenoid - Dicarboxylic acid or derivatives - Heteroaromatic compound - Azole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tertiary carboxylic acid amide - Thiazole - Amino acid or derivatives - Secondary carboxylic acid amide - Azetidine - Carboxylic acid ester - Carboxamide group - Thioether - Hemithioaminal - Azacycle - Carboxylic acid derivative - Dialkylthioether - Organochloride - Carbonyl group - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Primary amine - Organohalogen 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