Compound Identification
SMILES
COP(O)(=O)C1N2[C@H](SC1(C)C)C(NC(=O)C(C1=CC=CC=C1)S(O)(=O)=O)C2=O
InChIKey
InChIKey=MNFPHRULHZBHKO-ULKLSYCYSA-N
Formula
C16H21N2O8PS2
Mass
464.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Penams
- Level 6 Penicillins
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Level 5
Penams
-
Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Penams
Direct Parent
Penicillins
Alternative Parents
N-acyl-alpha amino acids and derivatives Phenylacetamides Phosphonic acid esters Alkanesulfonic acids Thiazolidines Tertiary carboxylic acid amides Sulfonyls Organosulfonic acids Organic phosphonic acids Secondary carboxylic acid amides Azetidines Thiohemiaminal derivatives Azacyclic compounds Dialkylthioethers Organophosphorus compounds Carbonyl compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Penicillin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Phenylacetamide - Monocyclic benzene moiety - Phosphonic acid ester - Benzenoid - Organophosphonic acid - Organophosphonic acid derivative - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Tertiary carboxylic acid amide - Thiazolidine - Alkanesulfonic acid - Azetidine - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Organophosphorus compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as penicillins. These are organic compounds containing the penicillin core structure, which is structurally characterized by a penam ring bearing two methyl groups at position 2, and an amide group at position 6 [starting from the sulfur atom at position 1].
External Descriptors
Not available