Compound Identification
SMILES
NC1=NC(=CS1)C(=N\OC1CCCC1)\C(=O)N[C@H]1[C@H]2SCC(\C(C(CC(=O)N(O)C3=CC=CC=C3)C3=CC=[NH+]C=C3)=C3\CCNC3=O)=C(N2C1=O)C([O-])=O
InChIKey
InChIKey=UQWSLGMWQXMSND-JOPFORAWSA-N
Formula
C36H36N8O8S2
Mass
772.85
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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
N-acyl-alpha amino acids and derivatives N-aryl-N-hydroxylamides Anilides 2,4-disubstituted thiazoles 2-amino-1,3-thiazoles Pyrrolidine-2-ones 1,3-thiazines Pyridinium derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids Secondary carboxylic acid amides Azetidines Carboxylic acid salts Monocarboxylic acids and derivatives Thiohemiaminal derivatives Dialkylthioethers Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - N-aryl-n-hydroxylamide - Alpha-amino acid or derivatives - Anilide - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - Monocyclic benzene moiety - Pyridine - Pyridinium - Pyrrolidone - 2-pyrrolidone - Benzenoid - 1,3-thiazol-2-amine - Thiazole - Tertiary carboxylic acid amide - Pyrrolidine - Azole - Heteroaromatic compound - Carboxylic acid salt - Hydroxamic acid - Secondary carboxylic acid amide - Amino acid - Amino acid or derivatives - Carboxamide group - Azetidine - Dialkylthioether - Azacycle - Monocarboxylic acid or derivatives - Thioether - Carboxylic acid derivative - Carboxylic acid - Hemithioaminal - Amine - Organic oxide - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - Organooxygen compound - Primary amine - Organic salt - Organic oxygen 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