Spektraris NMR
Pulcherrimin F
Common Name: Pulcherrimin F
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C29H34O8/c1-16-19-11-14-35-21(19)15-20-22(16)23(36-17(2)30)24(37-25(31)18-9-6-5-7-10-18)29(34)27(20,3)12-8-13-28(29,4)26(32)33/h5-7,9-11,14,16,20,22-24,34H,8,12-13,15H2,1-4H3,(H,32,33)/t16-,20-,22-,23+,24+,27+,28+,29-/m0/s1
InChIKey: InChIKey=LOULYRQGQVJALI-IJCRQOICSA-N
Formula: C29H34O8
Molecular Weight: 510.576566
Exact Mass: 510.225368
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Roach, J.S., McLean, S., Reynolds, W.F., Tinto, W.F. J Nat Prod (2003) 66, 1378-81
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Vouacapanes; 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) | 34.5 |
| 2 (CH2) | 18.5 |
| 3 (CH2) | 33.7 |
| 4 (C) | 48.7 |
| 5 (C) | 77.8 |
| 6 (CH) | 69.1 |
| 7 (CH) | 71.5 |
| 8 (CH) | 35.3 |
| 9 (CH) | 37.3 |
| 10 (C) | 41.2 |
| 11 (CH2) | 22.3 |
| 12 (C) | 149 |
| 13 (C) | 121.3 |
| 14 (CH) | 27.2 |
| 15 (CH) | 109.4 |
| 16 (CH) | 140.8 |
| 17 (CH3) | 17 |
| 18 (CH3) | 17.8 |
| 19 (C) | 179.7 |
| 20 (CH3) | 24.1 |
| 6a (C) | 166 |
| 6b (C) | 130.4 |
| 6c (CH) | 129.6 |
| 6d (CH) | 128.5 |
| 6e (CH) | 132.8 |
| 6f (CH) | 128.5 |
| 6g (CH) | 129.6 |
| 7a (C) | 171 |
| 7b (CH3) | 20.9 |
