Spektraris NMR
Rabdoternin D
Common Name: Rabdoternin D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H32O6/c1-11-13-8-14(24)15-20-7-5-6-19(3,4)16(20)18(28-12(2)23)22(26,27-10-20)21(15,9-13)17(11)25/h13-18,24-26H,1,5-10H2,2-4H3/t13-,14+,15+,16-,17-,18+,20-,21+,22-/m1/s1
InChIKey: InChIKey=RVGUSIYBDZFWQY-UNIHPGIPSA-N
Formula: C22H32O6
Molecular Weight: 392.486723
Exact Mass: 392.219889
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Takeda, Y., Takeda, K.I., Fujita, T., Sun, H.D., Minami, Y. Phytochemistry (1994) 35, 1513-6
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 31.5 |
| 2 (CH2) | 18.9 |
| 3 (CH2) | 41.2 |
| 4 (C) | 34 |
| 5 (CH) | 50.8 |
| 6 (CH) | 74.2 |
| 7 (C) | 98.3 |
| 8 (C) | 54.3 |
| 9 (CH) | 55.9 |
| 10 (C) | 37.6 |
| 11 (CH) | 60.6 |
| 12 (CH2) | 43.6 |
| 13 (CH) | 46.4 |
| 14 (CH2) | 76.1 |
| 15 (CH) | 72.9 |
| 16 (C) | 160.1 |
| 17 (CH2) | 109.8 |
| 18 (CH3) | 32.1 |
| 19 (CH3) | 22.4 |
| 20 (CH2) | 66.9 |
| 6a (C) | 168.8 |
| 6b (CH3) | 21.3 |
