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FURNA

PDB CCD ID: PSU
Number of entries in FURNA: 1
Chemical formula: C9 H13 N2 O9 P
InChI: InChI=1S/C9H13N2O9P/c12-5-4(2-19-21(16,17)18)20-7(6(5)13)3-1-10-9(15)11-8(3)14/h1,4-7,12-13H,2H2,(H2,16,17,18)(H2,10,11,14,15)/t4-,5-,6-,7+/m1/s1
InChIKey: MOBMOJGXNHLLIR-GBNDHIKLSA-N
SMILES: O=P(OCC2OC(C1=CNC(=O)NC1=O)C(O)C2O)(O)O;
O[CH]1[CH](O)[CH](O[CH]1CO[P](O)(O)=O)C2=CNC(=O)NC2=O;
C1=C(C(=O)NC(=O)N1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O;
O[C@H]1[C@@H](O)[C@@H](O[C@@H]1CO[P](O)(O)=O)C2=CNC(=O)NC2=O;
C1=C(C(=O)NC(=O)N1)C2C(C(C(O2)COP(=O)(O)O)O)O
Name:PSEUDOURIDINE-5'-MONOPHOSPHATE
DrugBank: DB03829
ZINC: ZINC000004095566
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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