Compound ID | 2962

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Blasticidin derivative 20

Class: Nucleoside analogue

Spectrum of activity: Gram-positive
Details of activity: Active against Staphylococcus aureus
Description: Semisynthetic compound derived from the natural product blasticidin; selectivity index at 26 (MRC-5 [lung fibroblast] CC50 vs Staphylococcus aureus MIC); a peptidylnucleoside
Year first mentioned: 2024
Development status: Experimental
Chemical structure(s):
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Molecular weight: 465.51
Iso. SMILES: NC(N(C)CC[C@H](N)CC(N[C@H]1C=C[C@H](N2C=CC(N)=NC2=O)O[C@@H]1C(NCCO)=O)=O)=N
InChI Key: HEOGWLNEBCXQFY-RKLWJJNISA-N
Can. SMILES: CN(CC[C@@H](CC(=O)N[C@H]1C=C[C@H](N2C=CC(=NC2=O)N)O[C@@H]1C(=O)NCCO)N)C(=N)N
InChI: InChI=1S/C19H31N9O5/c1-27(18(22)23)7-4-11(20)10-14(30)25-12-2-3-15(28-8-5-13(21)26-19(28)32)33-16(12)17(31)24-6-9-29/h2-3,5,8,11-12,15-16,29H,4,6-7,9-10,20H2,1H3,(H3,22,23)(H,24,31)(H,25,30)(H2,21,26,32)/t11-,12-,15+,16-/m0/s1
External links:
Citation: https://pubs.acs.org/doi/10.1021/acsmedchemlett.3c00527

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