Compound Identification
SMILES
CC1(C)S[C@@H]2[C@H](N3C(=O)C4=CC=CC=C4C3=O)C(=O)N2[C@H]1NC(=O)N[C@@H]1N2[C@H](SC1(C)C)[C@H](N1C(=O)C3=CC=CC=C3C1=O)C2=O
InChIKey
InChIKey=QOHBYLZHUZCIDD-OZZWUDFDSA-N
Formula
C31H28N6O7S2
Mass
660.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Lactams
-
Subclass
Beta lactams
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Level 5
Penams
- Level 6 Penicillins
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Level 5
Penams
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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
Phthalimides Alpha amino acids and derivatives Pyrrolidine-2-ones N-substituted carboxylic acid imides N-alkylpyrrolidines N-acyl amines Benzenoids Thiazolidines Tertiary carboxylic acid amides N,S-acetals Dicarboximides Organic carbonic acids and derivatives Azetidines Sulfenyl compounds Dialkylthioethers Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Penicillin - Phthalimide - Isoindolone - Alpha-amino acid or derivatives - Isoindole or derivatives - Isoindoline - Benzenoid - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - N-acyl-amine - N,s-acetal - Thiazolidine - Tertiary carboxylic acid amide - Pyrrolidine - Dicarboximide - Carboxylic acid imide - Carbonic acid derivative - Carboxamide group - Azetidine - Azacycle - Dialkylthioether - Sulfenyl compound - Hemithioaminal - Thioether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen 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