Spektraris NMR
19-Malonyloxy-ent-isopimara-8(9),15-diene
Common Name: 19-Malonyloxy-ent-isopimara-8(9),15-diene
Synonyms: 19-Malonyloxy-ent-isopimara-8(9),15-diene
CAS Registry Number:
InChI: InChI=1S/C23H34O4/c1-5-21(2)12-9-17-16(14-21)7-8-18-22(3,10-6-11-23(17,18)4)15-27-20(26)13-19(24)25/h5,18H,1,6-15H2,2-4H3,(H,24,25)/t18-,21+,22-,23-/m0/s1
InChIKey: InChIKey=MABMDRZLCMPGFD-AWDZXFJFSA-N
Formula: C23H34O4
Molecular Weight: 374.514531
Exact Mass: 374.24571
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Woldemichael, G.M., Wachter, G., Singh, M.P., Maiese, W.M., Timmermann, B.N. J Nat Prod (2003) 66, 242-6
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Pimaranes; 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) | 36.3 |
| 2 (CH2) | 18.5 |
| 3 (CH2) | 35.9 |
| 4 (C) | 37.1 |
| 5 (CH) | 52.5 |
| 6 (CH2) | 19 |
| 7 (CH2) | 32.7 |
| 8 (C) | 124.5 |
| 9 (C) | 136.5 |
| 10 (C) | 37.3 |
| 11 (CH2) | 21.2 |
| 12 (CH2) | 34.9 |
| 13 (C) | 35 |
| 14 (CH2) | 41.8 |
| 15 (CH) | 146.1 |
| 16 (CH2) | 110.7 |
| 17 (CH3) | 28 |
| 18 (CH3) | 27 |
| 19 (CH2) | 68.9 |
| 20 (CH3) | 19.9 |
| 19a (C) | 167.4 |
| 19b (CH2) | 40.6 |
| 19c (C) | 170.7 |
