Compound Identification
SMILES
CC(=O)N[C@@]1([C@@H]2SCC(COC(=O)C(C)(C)C)=C(N2C1=O)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CS1
InChIKey
InChIKey=QJMWPMXHIZCKCO-NYDCQLBNSA-N
Formula
C32H32N2O6S2
Mass
604.74
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Cephems
-
Level 6
Cephalosporins
- Level 7 Cephalosporin 3'-esters
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Level 6
Cephalosporins
-
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 - Cephalosporins
Direct Parent
Cephalosporin 3'-esters
Alternative Parents
Diphenylmethanes N-acyl-alpha amino acids and derivatives Benzyloxycarbonyls 1,3-thiazines Dicarboxylic acids and derivatives Thiophenes Acetamides Tertiary carboxylic acid amides Enoate esters Heteroaromatic compounds Tertiary amines Azetidines Secondary carboxylic acid amides Azacyclic compounds Dialkylthioethers Thiohemiaminal derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin 3'-ester - Diphenylmethane - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Meta-thiazine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Heteroaromatic compound - Acetamide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Thiophene - Tertiary carboxylic acid amide - Amino acid or derivatives - Azetidine - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Tertiary amine - Dialkylthioether - Azacycle - Carboxylic acid derivative - Hemithioaminal - Thioether - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cephalosporin 3'-esters. These are cephalosporins that are esterified at the 3'-position.
External Descriptors
Not available