SEQ2FUN

FURNA

PDB CCD ID: 38E
Number of entries in FURNA: 4
Chemical formula: C12 H10 F2 N2 O2
InChI: InChI=1S/C12H10F2N2O2/c1-6-15-10(12(18)16(6)2)5-7-3-8(13)11(17)9(14)4-7/h3-5,17H,1-2H3/b10-5-
InChIKey: ZDDIJYXDUBFLID-YHYXMXQVSA-N
SMILES: O=C1C(\N=C(N1C)C)=C\c2cc(F)c(O)c(F)c2;
CN1C(=NC(=Cc2cc(F)c(O)c(F)c2)C1=O)C;
CC1=NC(=Cc2cc(c(c(c2)F)O)F)C(=O)N1C;
CC1=N/C(=C\c2cc(c(c(c2)F)O)F)/C(=O)N1C;
CN1C(=NC(=C/c2cc(F)c(O)c(F)c2)\C1=O)C
Name:(5Z)-5-(3,5-difluoro-4-hydroxybenzylidene)-2,3-dimethyl-3,5-dihydro-4H-imidazol-4-one
ZINC: ZINC000098208407

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