Compound Identification
SMILES
[I-].COC1=CC=C(COC(=O)C2=C(C[P+](C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)CSC3C(NC(=O)CC4=CC=CC=C4)C(=O)N23)C=C1
InChIKey
InChIKey=MSZHSLFRIMNHJJ-UHFFFAOYSA-N
Formula
C42H38IN2O5PS
Mass
840.71
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
N-acyl-alpha amino acids and derivatives Benzyloxycarbonyls Phenylacetamides Anisoles Methoxybenzenes Phenoxy compounds Phenylphosphines and derivatives Alkyl aryl ethers 1,3-thiazines Tertiary carboxylic acid amides Enoate esters Secondary carboxylic acid amides Azetidines Azacyclic compounds Monocarboxylic acids and derivatives Thiohemiaminal derivatives Dialkylthioethers Carbonyl compounds Hydrocarbon derivatives Organic iodide salts Organic oxides Organic zwitterions Organonitrogen compounds Organophosphorus compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triphenylphosphine - Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Phenylacetamide - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Phenylphosphine - Meta-thiazine - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid ester - Hemithioaminal - Thioether - Dialkylthioether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Azacycle - Organic oxygen compound - Organic iodide salt - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organophosphorus compound - Organic oxide - Organic salt - 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