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FURNA

PDB CCD ID: J8F
Number of entries in FURNA: 5
Chemical formula: C19 H17 N3 O
InChI: InChI=1S/C19H17N3O/c1-22(10-11-23)19-8-4-15(5-9-19)12-18(14-21)17-6-2-16(13-20)3-7-17/h2-9,12,23H,10-11H2,1H3/b18-12+
InChIKey: DIAVZHWDYXQAFC-LDADJPATSA-N
SMILES: CN(CCO)c1ccc(cc1)/C=C(\C#N)/c2ccc(cc2)C#N;
CN(CCO)c1ccc(cc1)C=C(C#N)c2ccc(cc2)C#N;
CN(CCO)c1ccc(cc1)\C=C(C#N)\c2ccc(cc2)C#N
Name:4-[(~{Z})-1-cyano-2-[4-[2-hydroxyethyl(methyl)amino]phenyl]ethenyl]benzenecarbonitrile
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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