Spektraris NMR
Stictane
Common Name: Stictane
Synonyms: Stictane
CAS Registry Number:
InChI: InChI=1S/C30H52/c1-25(2)18-19-27(5)21(20-25)12-16-29(7)23(27)10-11-24-28(6)15-9-14-26(3,4)22(28)13-17-30(24,29)8/h21-24H,9-20H2,1-8H3/t21-,22+,23+,24+,27-,28+,29+,30+/m1/s1
InChIKey: InChIKey=FIRKAFOUSHHQPQ-OWEYPWNLSA-N
Formula: C30H52
Molecular Weight: 412.734996
Exact Mass: 412.406902
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wilkins A. L., Bremer J., Ralph J., Holland P. T., Ronaldson K. J., Jager P. M., Bird P. W. Aust J Chem (1989) 42, 243
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Stictanes; 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) | 34.6 |
| 2 (CH2) | 20.2 |
| 3 (CH2) | 41.5 |
| 4 (C) | 33.7 |
| 5 (CH) | 49.1 |
| 6 (CH2) | 19.5 |
| 7 (CH2) | 34.5 |
| 8 (C) | 42 |
| 9 (CH) | 46 |
| 10 (C) | 37.2 |
| 11 (CH2) | 22.7 |
| 12 (CH2) | 21.8 |
| 13 (CH) | 48.6 |
| 14 (C) | 43.3 |
| 15 (CH2) | 32.1 |
| 16 (CH2) | 25.9 |
| 17 (CH) | 42.8 |
| 18 (C) | 36.6 |
| 19 (CH2) | 34.8 |
| 20 (CH2) | 36 |
| 21 (C) | 30.6 |
| 22 (CH2) | 42.1 |
| 23 (CH3) | 33.9 |
| 24 (CH3) | 22 |
| 25 (CH3) | 23.1 |
| 26 (CH3) | 22.6 |
| 27 (CH3) | 17.2 |
| 28 (CH3) | 12.1 |
| 29 (CH3) | 33.5 |
| 30 (CH3) | 23 |
