Compound ID | 2268

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4,6-diaryl-5,7-dimethyl coumarin

Synonym(s): CCA34

Class: Small molecule antibacterial agent

Details of activity: Active against Mycobacterium sp.; mycolic acid synthesis inhibitor
Description: Synthetic compound (coumarin)
Year first mentioned: 2013
Development status: Experimental
Chemical structure(s):
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Molecular weight: 440.53
Iso. SMILES: NC1=CC=CC(C2=CC(OC3=C2C(C)=C(C4=CC=C(CN5CCOCC5)C=C4)C(C)=C3)=O)=C1
InChI Key: YPQNZMSVZYWEFI-UHFFFAOYSA-N
Can. SMILES: CC1=C(C(=C2C(=CC(=O)OC2=C1)C3=CC(=CC=C3)N)C)C4=CC=C(C=C4)CN5CCOCC5
InChI: InChI=1S/C28H28N2O3/c1-18-14-25-28(24(16-26(31)33-25)22-4-3-5-23(29)15-22)19(2)27(18)21-8-6-20(7-9-21)17-30-10-12-32-13-11-30/h3-9,14-16H,10-13,17,29H2,1-2H3
External links:
Citation: https://www.pnas.org/doi/full/10.1073/pnas.1302114110

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