Compound Identification
SMILES
CO[C@]1(NC(=O)CCCC(N)C(O)=O)[C@H]2SCC(COC(N)=O)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=LXWBXEWUSAABOA-MQWBZMFZSA-N
Formula
C16H22N4O9S
Mass
446.43
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
Cephamycins N-acyl-alpha amino acids and derivatives Alpha amino acids Medium-chain fatty acids Heterocyclic fatty acids N-acyl amines Dicarboxylic acids and derivatives 1,3-thiazines Carbamate esters Tertiary carboxylic acid amides Amino acids Azetidines Organic carbonic acids and derivatives Secondary carboxylic acid amides Carboxylic acids Thiohemiaminal derivatives Dialkylthioethers Azacyclic compounds Organopnictogen compounds Carbonyl compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cephalosporin 3'-carbamate - Cephamycin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid - Alpha-amino acid or derivatives - Medium-chain fatty acid - Heterocyclic fatty acid - Meta-thiazine - N-acyl-amine - Fatty amide - Fatty acyl - Dicarboxylic acid or derivatives - Tertiary carboxylic acid amide - Carbamic acid ester - Carbonic acid derivative - Secondary carboxylic acid amide - Azetidine - Amino acid - Carboxamide group - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkylthioether - Hemithioaminal - Thioether - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxide - Primary amine - Primary aliphatic amine - Organooxygen compound - Organonitrogen compound - Aliphatic 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