Compound Identification
SMILES
O=CN[C@H]1[C@H]2SCC(C[P+](C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)=C(N2C1=O)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=ZNGAPCDSDPYTEY-JGBHCADMSA-O
Formula
C40H34N2O4PS
Mass
669.76
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
-
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
Diphenylmethanes N-formyl-alpha amino acids Benzyloxycarbonyls Phenylphosphines and derivatives 1,3-thiazines Tertiary carboxylic acid amides Enoate esters Secondary carboxylic acid amides Azetidines Thiohemiaminal derivatives Azacyclic compounds Dialkylthioethers Monocarboxylic acids and derivatives Organonitrogen compounds Organopnictogen compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Organophosphorus compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triphenylphosphine - Cephalosporin - Diphenylmethane - N-formyl-alpha amino acid or derivatives - N-formyl-alpha-amino acid - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Phenylphosphine - Meta-thiazine - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Dialkylthioether - Hemithioaminal - Monocarboxylic acid or derivatives - Thioether - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organophosphorus compound - Organonitrogen compound - Organooxygen compound - Organic cation - 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