Bioinspired computational design of lankacidin derivatives for improvement in antitumor activity - supplement information

Table S1. 1H- and 13C-NMR data of lankacidin C (1), 7-O-acetyl-lankacidin C (2), 13-Oacetyl- lankacidin C (3), and 7,13-di-O-acetyl-lankacidin C (4) Table S2. 1H- and 13C-NMR data of lankacidin C (1), 7-O-cinnamoyl-lankacidin C (5), 13- O-cinnamoyl-lankacidin C (6), 7,13-di-O-cinnamoyl-lankacidin C (7), 7-Ohydrocinnamoyl- lankacidin C (8), 13-O-hydrocinnamoyl-lankacidin C (9), and 7,13-di-O-hydrocinnamoyl-lankacidin C (10) Figure S1. 1H-NMR spectrum of lankacidin C (1) Figure S2. 13C-NMR spectrum of lankacidin C (1) Figure S3. DEPT spectrum of lankacidin C (1) Figure S4. DQF-COSY spectrum of lankacidin C (1) Figure S5. HMQC spectrum of lankacidin C (1) Figure S6. HMBC spectrum of lankacidin C (1) Figure S7. 1H-NMR spectrum of 7-O-Ac-lankacidin C (2) Figure S8. 13C-NMR spectrum of 7-O-Ac-lankacidin C (2) Figure S9. DEPT spectrum of 7-O-Ac-lankacidin C (2) Figure S10. DQF-COSY spectrum of 7-O-Ac-lankacidin C (2) Figure S11. HMQC spectrum of 7-O-Ac-lankacidin C (2) Figure S12. HMBC spectrum of 7-O-Ac-lankacidin C (2) Figure S13. 1H-NMR spectrum of 13-O-Ac-lankacidin C (3) Figure S14. 13C-NMR spectrum of 13-O-Ac-lankacidin C (3) Figure S15. DEPT spectrum of 13-O-Ac-lankacidin C (3) Figure S16. DQF-COSY spectrum of 13-O-Ac-lankacidin C (3) Figure S17. HMQC spectrum of 13-O-Ac-lankacidin C (3) Figure S18. HMBC spectrum of 13-O-Ac-lankacidin C (3) Figure S19. 1H-NMR spectrum of 7,13-di-O-Ac-lankacidin C (4) Figure S20. 13C-NMR spectrum of 7,13-di-O-Ac-lankacidin C (4) Figure S21. DEPT spectrum of 7,13-di-O-Ac-lankacidin C (4) Figure S22. DQF-COSY spectrum of 7,13-di-O-Ac-lankacidin C (4) Figure S23. HMQC spectrum of 7,13-di-O-Ac-lankacidin C (4) Figure S24. HMBC spectrum of 7,13-di-O-Ac-lankacidin C (4) Figure S25. 1H-NMR spectrum of 7-O-cinnamoyl-lankacidin C (5) Figure S26. 13C-NMR spectrum of 7-O-cinnamoyl-lankacidin C (5) Figure S27. DEPT spectrum of 7-O-cinnamoyl-lankacidin C (5) Figure S28. DQF-COSY spectrum of 7-O-cinnamoyl-lankacidin C (5) Figure S29. HMQC spectrum of 7-O-cinnamoyl-lankacidin C (5) Figure S30. HMBC spectrum of 7-O-cinnamoyl-lankacidin C (5) Figure S31. 1H-NMR spectrum of 13-O-cinnamoyl-lankacidin C (6) Figure S32. 13C-NMR spectrum of 13-O-cinnamoyl-lankacidin C (6) Figure S33. DEPT spectrum of 13-O-cinnamoyl-lankacidin C (6) Figure S34. DQF-COSY spectrum of 13-O-cinnamoyl-lankacidin C (6) Figure S35. HMQC spectrum of 13-O-cinnamoyl-lankacidin C (6) Figure S36. HMBC spectrum of 13-O-cinnamoyl-lankacidin C (6) Figure S37. 1H-NMR spectrum of