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FURNA

PDB CCD ID: EZM
Number of entries in FURNA: 2
Chemical formula: C15 H24 N4 O5
InChI: InChI=1S/C15H24N4O5/c16-8-2-1-3-12(17)15(22)18-13(9-20)14(21)10-4-6-11(7-5-10)19(23)24/h4-7,12-14,20-21H,1-3,8-9,16-17H2,(H,18,22)/t12-,13+,14+/m0/s1
InChIKey: LSXOPXJWOLKWDK-BFHYXJOUSA-N
SMILES: NCCCC[CH](N)C(=O)N[CH](CO)[CH](O)c1ccc(cc1)[N+]([O-])=O;
c1cc(ccc1C(C(CO)NC(=O)C(CCCCN)N)O)[N+](=O)[O-];
c1cc(ccc1[C@H]([C@@H](CO)NC(=O)[C@H](CCCCN)N)O)[N+](=O)[O-];
NCCCC[C@H](N)C(=O)N[C@H](CO)[C@H](O)c1ccc(cc1)[N+]([O-])=O;
c1cc([N+]([O-])=O)ccc1C(O)C(NC(C(N)CCCCN)=O)CO
Name:N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-L-lysinamide
Reference:
  • Chengxin Zhang, P. Lydia Freddolino (2023) FURNA: a database for function annotations of RNA structures, bioRxiv 2023.12.19.572314.

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