Spektraris NMR
Ganodermanontriol
Common Name: Ganodermanontriol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H48O4/c1-19(8-11-25(33)30(7,34)18-31)20-12-16-29(6)22-9-10-23-26(2,3)24(32)14-15-27(23,4)21(22)13-17-28(20,29)5/h9,13,19-20,23,25,31,33-34H,8,10-12,14-18H2,1-7H3/t19-,20-,23+,25+,27-,28-,29+,30?/m1/s1
InChIKey: InChIKey=KASALCUNLBTNAA-VIKWRQSJSA-N
Formula: C30H48O4
Molecular Weight: 472.700853
Exact Mass: 472.35526
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Arisawa, M., Fujita, A., Hayashi, T., Shimizu, M., Morita, N. J Nat Prod (1988) 51, 54-9
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Lanostanes; 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) | 36.6 |
| 2 (CH2) | 34.8 |
| 3 (C) | 217 |
| 4 (C) | 47.5 |
| 5 (CH) | 50.3 |
| 6 (CH2) | 23.6 |
| 7 (CH) | 119.9 |
| 8 (C) | 142.8 |
| 9 (C) | 144.4 |
| 10 (C) | 37.2 |
| 11 (CH) | 117.2 |
| 12 (CH2) | 37.8 |
| 13 (C) | 43.7 |
| 14 (C) | 50.7 |
| 15 (CH2) | 31.5 |
| 16 (CH2) | 27.9 |
| 17 (CH) | 51 |
| 18 (CH3) | 15.7 |
| 19 (CH3) | 22 |
| 20 (CH) | 36.6 |
| 21 (CH3) | 18.6 |
| 22 (CH2) | 33.5 |
| 23 (CH2) | 28.8 |
| 24 (CH) | 79.1 |
| 25 (C) | 74.1 |
| 26 (CH2) | 67.6 |
| 27 (CH3) | 20.9 |
| 28 (CH3) | 25.4 |
| 29 (CH3) | 22.4 |
| 30 (CH3) | 25.4 |
