Spektraris NMR
Xanthanthusin F
Common Name: Xanthanthusin F
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H30O9/c1-10(25)7-14-17(28)15-16(21(18(14)29)33-12(3)27)24(6)9-13(32-11(2)26)8-23(4,5)22(24)20(31)19(15)30/h10,13,25,28-29,31H,7-9H2,1-6H3/t10?,13-,24+/m0/s1
InChIKey: InChIKey=ZLPMIHAVSWBSMF-DJFZVPLDSA-N
Formula: C24H30O9
Molecular Weight: 462.490528
Exact Mass: 462.188983
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Mei, S.X., Jiang, B., Niu, X.M., Li, M.L., Yang, H., Na, Z., Lin, Z.W., Li, C.M., Sun, H.D. J Nat Prod (2002) 65, 633-7
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Lanugons; 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 |
|---|---|
| 1 (CH2) | 38 |
| 2 (CH) | 68.5 |
| 3 (CH2) | 41.6 |
| 4 (C) | 36 |
| 5 (C) | 140.6 |
| 6 (C) | 141.5 |
| 7 (C) | 182.2 |
| 8 (C) | 105.3 |
| 9 (C) | 143.2 |
| 10 (C) | 40.9 |
| 11 (C) | 130.5 |
| 12 (C) | 155.9 |
| 13 (C) | 112.2 |
| 14 (C) | 160 |
| 15 (CH2) | 30.8 |
| 16 (CH) | 70.3 |
| 17 (CH3) | 22.7 |
| 18 (CH3) | 28 |
| 19 (CH3) | 27.2 |
| 20 (CH3) | 29.4 |
| 2a (C) | 168.7 |
| 2b (CH3) | 20.9 |
| 11a (C) | 170.3 |
| 11b (CH3) | 21.3 |
