Compound Identification
SMILES
CC1=NC2=NC(=NN2C(SCC2=C(N3[C@H](SC2)[C@H](NC(=O)C(=N/OC(=O)C2=CC(OC(=O)CCl)=C(OC(=O)CCl)C(OC(=O)CCl)=C2)\C2=CSC(N)=N2)C3=O)C(O)=O)=C1)C(O)=O
InChIKey
InChIKey=JRRSZAPXDWERFN-BXVMDIMVSA-N
Formula
C33H24Cl3N9O14S3
Mass
973.13
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Lactams
-
Subclass
Beta lactams
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Level 5
Cephems
- Level 6 Cephalosporins
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Level 5
Cephems
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Subclass
Beta lactams
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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
Tetracarboxylic acids and derivatives N-acyl-alpha amino acids and derivatives Gallic acid and derivatives Phenol esters Triazolopyrimidines Phenoxy compounds Benzoyl derivatives 2,4-disubstituted thiazoles Alkylarylthioethers 1,3-thiazines 2-amino-1,3-thiazoles Pyrimidines and pyrimidine derivatives Alpha-halocarboxylic acid derivatives Oxime esters Tertiary carboxylic acid amides Triazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Azetidines Carboxylic acid esters Thiohemiaminal derivatives Azacyclic compounds Sulfenyl compounds Carboxylic acids Dialkylthioethers Carbonyl compounds Organic oxides Organochlorides Primary amines Alkyl chlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - Tetracarboxylic acid or derivatives - N-acyl-alpha amino acid or derivatives - Gallic acid or derivatives - Phenol ester - Alpha-amino acid or derivatives - Triazolopyrimidine - Benzoic acid or derivatives - Phenoxy compound - Aryl thioether - Benzoyl - Alkylarylthioether - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - Benzenoid - Pyrimidine - 1,3-thiazol-2-amine - Monocyclic benzene moiety - Alpha-halocarboxylic acid derivative - Heteroaromatic compound - Alpha-halocarboxylic acid or derivatives - Oximester - Tertiary carboxylic acid amide - 1,2,4-triazole - Azole - Triazole - Thiazole - Secondary carboxylic acid amide - Carboxamide group - Amino acid - Carboxylic acid ester - Amino acid or derivatives - Azetidine - Azacycle - Dialkylthioether - Sulfenyl compound - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Organosulfur compound - Primary amine - Organic oxide - Alkyl halide - Alkyl chloride - Organic oxygen compound - Amine - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organochloride - 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