Compound Identification
SMILES
NC1=NC(=CS1)C(=C\OCC1=CC(=NO1)C1=CC(=O)C(O)=CN1O)\C(=O)N[C@H]1[C@H]2SCC(CSC3=CC=[N+](CC([O-])=O)C=C3)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=RRDQWPDGYAMQNU-YXTLHEPFSA-N
Formula
C30H25N7O11S3
Mass
755.75
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
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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
N-acyl-alpha amino acids and derivatives 2,4-disubstituted thiazoles Alkylarylthioethers Dihydropyridines Hydroxypyridines 1,3-thiazines 2-amino-1,3-thiazoles Pyridinium derivatives Dicarboxylic acids and derivatives Vinylogous esters Vinylogous amides Tertiary carboxylic acid amides Heteroaromatic compounds Isoxazoles Secondary carboxylic acid amides Amino acids Azetidines Carboxylic acid salts Cyclic ketones Dialkylthioethers Sulfenyl compounds Carboxylic acids Thiohemiaminal derivatives Azacyclic compounds Oxacyclic compounds Primary amines Organic zwitterions Organic salts Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Hydroxypyridine - Dihydropyridine - Alkylarylthioether - Meta-thiazine - Dicarboxylic acid or derivatives - Hydropyridine - 1,3-thiazol-2-amine - Pyridine - Pyridinium - Azole - Heteroaromatic compound - Isoxazole - Vinylogous ester - Vinylogous amide - Tertiary carboxylic acid amide - Thiazole - Azetidine - Secondary carboxylic acid amide - Amino acid or derivatives - Cyclic ketone - Carboxamide group - Carboxylic acid salt - Amino acid - Dialkylthioether - Sulfenyl compound - Hemithioaminal - Thioether - Azacycle - Carboxylic acid derivative - Oxacycle - Carboxylic acid - Organic salt - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Amine - Organic zwitterion - 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