Spektraris NMR
Gelomulide P
Common Name: Gelomulide P
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H30O6/c1-10-17-12(27-19(10)25)8-14-21(5)13(6-7-22(14)18(17)28-22)20(3,4)15(24)9-16(21)26-11(2)23/h12-16,18,24H,6-9H2,1-5H3/t12-,13-,14+,15-,16-,18-,21-,22+/m1/s1
InChIKey: InChIKey=SXAXJWWFFVVXHY-XAYTXTDRSA-N
Formula: C22H30O6
Molecular Weight: 390.470842
Exact Mass: 390.204239
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Lee, C.L., Chang, F.R., Hsieh, P.W., Chiang, M.Y., Wu, C.C., Huang, Z.Y., Lan, Y.H., Chen, M., Lee, K.H., Yen, H.F., Hung, W.C., Wu, Y.C. Phytochemistry (2008) 69, 276-87
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abietanes; 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 (CH) | 75.8 |
| 2 (CH2) | 31.9 |
| 3 (CH) | 71.8 |
| 4 (C) | 39.4 |
| 5 (CH) | 48.8 |
| 6 (CH2) | 20.8 |
| 7 (CH2) | 34.6 |
| 8 (C) | 61.4 |
| 9 (CH) | 42.1 |
| 10 (C) | 42.4 |
| 11 (CH2) | 23.9 |
| 12 (CH) | 75.5 |
| 13 (C) | 156.4 |
| 14 (CH) | 56 |
| 15 (C) | 128.4 |
| 16 (C) | 173.9 |
| 17 (CH3) | 8.7 |
| 18 (CH3) | 29.3 |
| 19 (CH3) | 16.6 |
| 20 (CH3) | 18.5 |
| 1a (C) | 170 |
| 1b (CH3) | 20.8 |
