Compound ID | 721

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GL 579225

Class: Small molecule antibacterial agent

Agent Type: Synthetic; Small molecule; Direct acting;
Spectrum of activity: Gram-positive
Mechanism of action: DNA synthesis inhibitor. Binds to DNA minor groove
Target Pathogen: Active against vancomycin-resistant Enterococcus
Description: Polyheterocyclic amide
Institute where first reported: Genelabs Technologies
Year first mentioned: 2001
Development status: Experimental
Chemical structure(s):
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Molecular weight: 688.86
Iso. SMILES: CC(C)CCN1C=C(C=C1C(=O)NCCC(=NC)N)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCC(=NC)N)CCC(C)C
InChI Key: HUGIPKNLZQDVGP-UHFFFAOYSA-N
Can. SMILES: CC(C)CCN1C=C(C=C1C(=O)NCCC(=NC)N)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CN(CCC(C)C)C(=C3)C(=O)NCCC(=NC)N
InChI: InChI=1S/C36H52N10O4/c1-23(2)13-17-45-21-27(19-29(45)35(49)41-15-11-31(37)39-5)43-33(47)25-7-9-26(10-8-25)34(48)44-28-20-30(46(22-28)18-14-24(3)4)36(50)42-16-12-32(38)40-6/h7-10,19-24H,11-18H2,1-6H3,(H2,37,39)(H2,38,40)(H,41,49)(H,42,50)(H,43,47)(H,44,48)
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/9831434
Citation: https://pubs.acs.org/doi/10.1021/jm010375a

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