Spektraris NMR
14-Norpseurotin A
Common Name: 14-Norpseurotin A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H23NO8/c1-4-8-13(23)14(24)15-11(2)16(25)20(30-15)18(27)21(29-3,22-19(20)28)17(26)12-9-6-5-7-10-12/h4-10,13-14,18,23-24,27H,1-3H3,(H,22,28)/b8-4-/t13-,14-,18+,20+,21+/m0/s1
InChIKey: InChIKey=FCGCMRDADMTJIM-LFDIKFNASA-N
Formula: C21H23N1O8
Molecular Weight: 417.410074
Exact Mass: 417.142367
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Zhang, M., Wang, W.L., Fang, Y.C., Zhu, T.J., Gu, Q.Q., Zhu, W.M. J Nat Prod (2008) 71, 985-9
Species:
Notes: Family : Alkaloids, Type : Pyrroles; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 2 (C) | 185.7 |
| 3 (C) | 113.7 |
| 4 (C) | 196.4 |
| 5 (C) | 92.6 |
| 6 (C) | 166.5 |
| 8 (C) | 90.2 |
| 9 (CH) | 73.2 |
| 10 (CH) | 70.3 |
| 11 (CH) | 70.4 |
| 12 (CH) | 128 |
| 13 (CH) | 129.8 |
| 15 (CH3) | 13.73 |
| 16 (CH3) | 6.03 |
| 17 (C) | 194.8 |
| 18 (C) | 132.3 |
| 19 (CH) | 130.7 |
| 20 (CH) | 128.8 |
| 21 (CH) | 134.8 |
| 22 (CH) | 128.8 |
| 23 (CH) | 130.7 |
| 8a (CH3) | 51.8 |
