Compound Identification
SMILES
OCCN1CCN(CC1)C(=O)OCC1=C(N2[C@H](C(NC(=O)CC3=CC=CC=C3)C2=O)S(=O)C1)C(O)=O
InChIKey
InChIKey=VCAFINLPLABSSE-WKNBQHKHSA-N
Formula
C23H28N4O8S
Mass
520.56
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
N-acyl-alpha amino acids and derivatives Phenylacetamides Piperazine carboxylic acids N-alkylpiperazines 1,3-thiazines Carbamate esters Tertiary carboxylic acid amides Sulfoxides Trialkylamines 1,2-aminoalcohols Azetidines Amino acids Secondary carboxylic acid amides Sulfinyl compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin 3'-carbamate - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Phenylacetamide - Piperazine-1-carboxylic acid - N-alkylpiperazine - Meta-thiazine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Carbamic acid ester - Tertiary carboxylic acid amide - Carboxamide group - 1,2-aminoalcohol - Azetidine - Amino acid or derivatives - Amino acid - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Sulfoxide - Alkanolamine - Azacycle - Carboxylic acid - Carboxylic acid derivative - Sulfinyl compound - Monocarboxylic acid or derivatives - Primary alcohol - Carbonyl group - Alcohol - Organic oxygen compound - Organonitrogen compound - Amine - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - 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