SEQ2FUN

FURNA

PDB CCD ID: ISH
Number of entries in FURNA: 1
Chemical formula: C17 H27 N5 O
InChI: InChI=1S/C17H27N5O/c1-20(2)8-5-9-22-16-13-10-12(11-21(3)4)23-15(13)7-6-14(16)19-17(22)18/h6-7,12H,5,8-11H2,1-4H3,(H2,18,19)/t12-/m1/s1
InChIKey: PFHMRNGLRJXGSW-GFCCVEGCSA-N
SMILES: CN(C)CCCn1c(N)nc2ccc3O[C@@H](CN(C)C)Cc3c12;
CN(C)CCCn1c2c(ccc3c2C[C@@H](O3)CN(C)C)nc1N;
CN(C)CCCn1c2c(ccc3c2CC(O3)CN(C)C)nc1N;
CN(C)CCCn1c(N)nc2ccc3O[CH](CN(C)C)Cc3c12
Name:(7R)-7-[(dimethylamino)methyl]-1-[3-(dimethylamino)propyl]-7,8-dihydro-1H-furo[3,2-e]benzimidazol-2-amine
ZINC: ZINC000013675184

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