Compound Identification
SMILES
CCOC1=C(C(=O)NC2C3SC(C)(C)C(N3C2=O)C(=O)OC)C2=CC=CC=C2C=C1
InChIKey
InChIKey=SGGFYIIPPJCMLR-UHFFFAOYSA-N
Formula
C22H24N2O5S
Mass
428.5
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
Alpha amino acid esters N-acyl-alpha amino acids and derivatives Naphthalenecarboxamides Phenol ethers Alkyl aryl ethers Tertiary carboxylic acid amides Thiazolidines Methyl esters Azetidines Secondary carboxylic acid amides Monocarboxylic acids and derivatives Dialkylthioethers Azacyclic compounds Thiohemiaminal derivatives Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Penicillin - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - 1-naphthalenecarboxamide - 1-naphthalenecarboxylic acid or derivatives - Alpha-amino acid or derivatives - Naphthalene - Phenol ether - Alkyl aryl ether - Benzenoid - Methyl ester - Thiazolidine - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Hemithioaminal - Dialkylthioether - Azacycle - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Thioether - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - 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