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FURNA

PDB CCD ID: BER
Number of entries in FURNA: 2
Chemical formula: C20 H18 N O4
InChI: InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1
InChIKey: YBHILYKTIRIUTE-UHFFFAOYSA-N
SMILES: COc1ccc2cc-3[n+](cc2c1OC)CCc4c3cc5c(c4)OCO5;
O1c2c(OC1)cc5c(c2)c4cc3ccc(OC)c(OC)c3c[n+]4CC5;
COc1ccc2cc3c4cc5OCOc5cc4CC[n+]3cc2c1OC
Name:BERBERINE
ChEMBL: CHEMBL295124
DrugBank: DB04115
ZINC: ZINC000003779067
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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