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FURNA

PDB CCD ID: NI4
Number of entries in FURNA: 12
Chemical formula: C22 H23 N3 O2
InChI: InChI=1S/C22H23N3O2/c1-24(14-15-26)19-11-8-18(9-12-19)16-20-22(27)25(2)21(23-20)13-10-17-6-4-3-5-7-17/h3-13,16,26H,14-15H2,1-2H3/b13-10+,20-16-
InChIKey: ZFOXSTQDZTYDAX-GHAMAFACSA-N
SMILES: CN1C(=NC(=Cc2ccc(cc2)N(C)CCO)C1=O)C=Cc3ccccc3;
CN(CCO)c1ccc(cc1)\C=C2/N=C(/C=C/c3ccccc3)N(C)C2=O;
CN1C(=N/C(=C\c2ccc(cc2)N(C)CCO)/C1=O)/C=C/c3ccccc3;
CN(CCO)c1ccc(cc1)C=C2N=C(C=Cc3ccccc3)N(C)C2=O
Name:(5~{Z})-5-[[4-[2-hydroxyethyl(methyl)amino]phenyl]methylidene]-3-methyl-2-[(~{E})-2-phenylethenyl]imidazol-4-one
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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