Spektraris NMR
Doianoterpene D
Common Name: Doianoterpene D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O3/c1-17(2)8-4-9-20(16(21)22)14(17)7-10-19-11-13(5-6-15(19)20)18(3,23)12-19/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13-,14-,15-,18-,19+,20+/m1/s1
InChIKey: InChIKey=LDNAOWMCPDDNLK-YMTVXDNUSA-N
Formula: C20H32O3
Molecular Weight: 320.467037
Exact Mass: 320.235145
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Tanaka, N., Ooba, N., Duan, H., Takaishi, Y., Nakanishi, Y., Bastow, K., Lee, K.H. Phytochemistry (2004) 65, 2071-6
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) | 40.1 |
| 2 (CH2) | 21.3 |
| 3 (CH2) | 42.9 |
| 4 (C) | 34.2 |
| 5 (CH) | 57.1 |
| 6 (CH2) | 21.2 |
| 7 (CH2) | 42.5 |
| 8 (C) | 46 |
| 9 (CH) | 55.5 |
| 10 (C) | 48.8 |
| 11 (CH2) | 18.9 |
| 12 (CH2) | 25.9 |
| 13 (CH) | 49.1 |
| 14 (CH2) | 36.5 |
| 15 (CH2) | 59 |
| 16 (C) | 77.9 |
| 17 (CH3) | 25 |
| 18 (CH3) | 33.5 |
| 19 (CH3) | 23 |
| 20 (C) | 179.1 |
