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FURNA

PDB CCD ID: J8O
Number of entries in FURNA: 1
Chemical formula: C17 H15 N5 O
InChI: InChI=1S/C17H15N5O/c1-22(6-7-23)17-12-20-16(11-21-17)8-15(10-19)14-4-2-13(9-18)3-5-14/h2-5,8,11-12,23H,6-7H2,1H3/b15-8+
InChIKey: KAAHKPAHANCLED-OVCLIPMQSA-N
SMILES: CN(CCO)c1cnc(cn1)C=C(C#N)c2ccc(cc2)C#N;
CN(CCO)c1cnc(cn1)/C=C(\C#N)/c2ccc(cc2)C#N;
CN(CCO)c1cnc(cn1)\C=C(/C#N)c2ccc(cc2)C#N
Name:4-[(~{Z})-1-cyano-2-[5-[2-hydroxyethyl(methyl)amino]pyrazin-2-yl]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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