Spektraris NMR
Nivulianol C
Common Name: Nivulianol C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C23H34O7/c1-12-8-9-16(21(5,6)27)18(28-7)17(25)13(2)10-23-20(29-15(4)24)14(3)11-22(23,30-23)19(12)26/h8-10,12,14,16-18,20,25,27H,11H2,1-7H3/b9-8-,13-10+/t12?,14-,16+,17+,18-,20-,22-,23-/m0/s1
InChIKey: InChIKey=ISEMKHGDEXYIFF-LZDIXKMCSA-N
Formula: C23H34O7
Molecular Weight: 422.512746
Exact Mass: 422.230453
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Srinivasulu, M., Reddy, V.L.N., Reddy, S.M., Ravikanth, V., Raju, T.V., Ramakrishna, S., Venkateswarlu, Y. Helv Chim Acta (2005) 88, 2527-31
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Lathyranes; 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) | 33.61 |
| 2 (CH) | 29.69 |
| 3 (CH) | 77.96 |
| 4 (C) | 73.73 |
| 5 (CH) | 117.01 |
| 6 (C) | 142.51 |
| 7 (CH) | 72.35 |
| 8 (CH) | 72.73 |
| 9 (CH) | 52.33 |
| 10 (C) | 83.01 |
| 11 (CH) | 132.25 |
| 12 (CH) | 129.36 |
| 13 (CH) | 45.68 |
| 14 (C) | 206.66 |
| 15 (C) | 73.21 |
| 16 (CH3) | 17.09 |
| 17 (CH3) | 17.09 |
| 18 (CH3) | 29.69 |
| 19 (CH3) | 25.33 |
| 20 (CH3) | 17.08 |
| 3a (C) | 170 |
| 3b (CH3) | 20.64 |
| 8a (CH3) | 56.44 |
