Compound Identification
SMILES
CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CCCC(=O)NC1[C@@H]2SCC(COC(=O)NC(=O)CCl)=C(N2C1=O)C(O)=O)C(O)=O
InChIKey
InChIKey=GPCYOGNRUQYGLB-KGGRFHARSA-N
Formula
C28H33ClN4O10S
Mass
653.1
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'-carbamates
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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'-carbamates
Alternative Parents
Hippuric acids N-acyl-alpha amino acids Phenylpropanes Benzoyl derivatives Medium-chain fatty acids Branched fatty acids Halogenated fatty acids Heterocyclic fatty acids N-acyl amines Dicarboxylic acids and derivatives 1,3-thiazines Tertiary carboxylic acid amides Dicarboximides Carbamate esters Tertiary amines Secondary carboxylic acid amides Amino acids Azetidines Azacyclic compounds Thiohemiaminal derivatives Dialkylthioethers Carboxylic acids Alkyl chlorides Organic oxides Hydrocarbon derivatives Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin 3'-carbamate - Hippuric acid or derivatives - Hippuric acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzamide - Benzoic acid or derivatives - Phenylpropane - Benzoyl - Medium-chain fatty acid - Branched fatty acid - Halogenated fatty acid - Heterocyclic fatty acid - Meta-thiazine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Fatty amide - Fatty acyl - Benzenoid - N-acyl-amine - Tertiary carboxylic acid amide - Dicarboximide - Carbamic acid ester - Tertiary amine - Secondary carboxylic acid amide - Azetidine - Amino acid - Carboxamide group - Amino acid or derivatives - Dialkylthioether - Hemithioaminal - Carboxylic acid - Carboxylic acid derivative - Azacycle - Thioether - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Alkyl chloride - Organic oxygen compound - Organohalogen compound - Organochloride - Organic nitrogen compound - Organooxygen compound - Amine - Alkyl halide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cephalosporin 3'-carbamates. These are cephalosporins that are substituted at the 3'-position by a carbamate group.
External Descriptors
Not available