Compound ID | 2263

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Clomiphene

Class: Cell wall synthesis inhibitor

Agent Type: Synthetic; Small molecule; Direct acting;
Spectrum of activity: Gram-positive
Mechanism of action: Cell wall synthesis inhibitor. Targets the undecaprenyl diphosphate synthase
Target Pathogen: Active against Staphylococcus aureus
Description: Synthetic compound from screening off-patent FDA-approved molecules; a fertility drug
Year first mentioned: 2015
Development status: Experimental, off-patent
Chemical structure(s):
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Molecular weight: 405.96
Iso. SMILES: CCN(CC)CCOC1=CC=C(C=C1)/C(=C(\C2=CC=CC=C2)/Cl)/C3=CC=CC=C3
InChI Key: GKIRPKYJQBWNGO-OCEACIFDSA-N
Can. SMILES: CCN(CC)CCOC1=CC=C(C=C1)/C(=C(\C2=CC=CC=C2)/Cl)/C3=CC=CC=C3
InChI: InChI=1S/C26H28ClNO/c1-3-28(4-2)19-20-29-24-17-15-22(16-18-24)25(21-11-7-5-8-12-21)26(27)23-13-9-6-10-14-23/h5-18H,3-4,19-20H2,1-2H3/b26-25+
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/1548953
Citation: https://www.pnas.org/doi/10.1073/pnas.1511751112

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