Spektraris NMR
Protosta-20,24-dien-3b-ol
Common Name: Protosta-20,24-dien-3b-ol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-29(7)23(22)12-13-25-28(6)17-16-26(31)27(4,5)24(28)15-19-30(25,29)8/h10,22-26,31H,3,9,11-19H2,1-2,4-8H3/t22-,23+,24+,25+,26+,28+,29+,30+/m1/s1
InChIKey: InChIKey=WZAMDSBJONFHAO-XLELZOGFSA-N
Formula: C30H50O1
Molecular Weight: 426.71852
Exact Mass: 426.386166
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wu, T.-K., Liu, Y.-T., Chang, C.-H., Yu, M.-T., Wang, H.-J. J Am Chem Soc (2006) 128, 6414-9
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Protostanes; 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) | 32.88 |
| 2 (CH2) | 29.11 |
| 3 (CH) | 79.33 |
| 4 (C) | 39.15 |
| 5 (CH) | 47.66 |
| 6 (CH2) | 18.57 |
| 7 (CH2) | 34.81 |
| 8 (C) | 39.95 |
| 9 (CH) | 45.68 |
| 10 (C) | 36.81 |
| 11 (CH2) | 23.09 |
| 12 (CH2) | 25.14 |
| 13 (CH) | 44.52 |
| 14 (C) | 50.67 |
| 15 (CH2) | 33.35 |
| 16 (CH2) | 27.65 |
| 17 (CH) | 43.88 |
| 18 (CH3) | 17.48 |
| 19 (CH3) | 22.38 |
| 20 (C) | 152.04 |
| 21 (CH2) | 108.78 |
| 22 (CH2) | 38.62 |
| 23 (CH2) | 27.3 |
| 24 (CH) | 124.36 |
| 25 (C) | 131.43 |
| 26 (CH3) | 25.7 |
| 27 (CH3) | 17.69 |
| 28 (CH3) | 29.08 |
| 29 (CH3) | 16.1 |
| 30 (CH3) | 21.98 |
