Compound Identification
SMILES
CC1(C)S[C@@H]2C(N3C(=O)C(NC3(C)C)C3=CC=C(O)C=C3)C(=O)N2[C@H]1C(O)=O
InChIKey
InChIKey=MFSKHDSIPVDCDE-GAWYNMALSA-N
Formula
C19H23N3O5S
Mass
405.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Lactams
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Subclass
Beta lactams
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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
Phenylimidazolidines Alpha amino acids and derivatives 1-hydroxy-2-unsubstituted benzenoids Imidazolidinones Benzene and substituted derivatives Thiazolidines Tertiary carboxylic acid amides Azetidines Thiohemiaminal derivatives Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylthioethers Hydrocarbon derivatives Carbonyl compounds Organic oxides Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Penicillin - Phenylimidazolidine - Alpha-amino acid or derivatives - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Imidazolidinone - Benzenoid - Thiazolidine - Tertiary carboxylic acid amide - Imidazolidine - Azetidine - Carboxamide group - Hemithioaminal - Thioether - Azacycle - Dialkylthioether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic oxide - 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