Compound Identification
SMILES
CC[C@@](C)(O\N=C(\C(=O)N[C@@H]1[C@H]2SCC(CSC3=C(C(O)=O)C(=O)NS3)=C(N2C1=O)C(O)=O)C1=NSC(N)=N1)C(=O)OC(C)(C)C
InChIKey
InChIKey=YRVINBYBOJCOJW-YPMUSKFKSA-N
Formula
C25H29N7O10S4
Mass
715.79
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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
-
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 Thiazolecarboxylic acids and derivatives Alkylarylthioethers Fatty acid esters Vinylogous thioesters 1,3-thiazines Dicarboxylic acids and derivatives Vinylogous amides Thiadiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids Azetidines Carboxylic acid esters Secondary carboxylic acid amides Dialkylthioethers Carboxylic acids Thiohemiaminal derivatives Sulfenyl compounds Azacyclic compounds Carbonyl compounds Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Thiazolecarboxylic acid or derivatives - Aryl thioether - Fatty acid ester - Alkylarylthioether - Meta-thiazine - Dicarboxylic acid or derivatives - Vinylogous thioester - Fatty acyl - Azole - Heteroaromatic compound - Vinylogous amide - Thiazole - Tertiary carboxylic acid amide - Thiadiazole - Amino acid or derivatives - Azetidine - Carboxamide group - Carboxylic acid ester - Amino acid - Secondary carboxylic acid amide - Thioether - Hemithioaminal - Dialkylthioether - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Organooxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Organic oxide - Organosulfur compound - Primary amine - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen 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