SEQ2FUN

FURNA

PDB CCD ID: U
Number of entries in FURNA: 49
Chemical formula: C9 H13 N2 O9 P
InChI: InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
InChIKey: DJJCXFVJDGTHFX-XVFCMESISA-N
SMILES: O=C1NC(=O)N(C=C1)C2OC(C(O)C2O)COP(=O)(O)O;
O[CH]1[CH](O)[CH](O[CH]1CO[P](O)(O)=O)N2C=CC(=O)NC2=O;
C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O;
C1=CN(C(=O)NC1=O)C2C(C(C(O2)COP(=O)(O)O)O)O;
O[C@H]1[C@@H](O)[C@@H](O[C@@H]1CO[P](O)(O)=O)N2C=CC(=O)NC2=O
Name:URIDINE-5'-MONOPHOSPHATE
ChEMBL: CHEMBL214393
DrugBank: DB03685
ZINC: ZINC000002123545

Reference:
  • Chengxin Zhang, Lydia Freddolino (2024) "FURNA: a database for function annotations of RNA structures," PLOS Biology 22(7): e3002476.