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-FIVVOIHPSA-N
Formula: C30H48O4
Molecular Weight: 472.700853
Exact Mass: 472.35526
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Qiao, Y., Zhang, X.M., Qiu, M.H. Molecules (2007) 12, 2038-46
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) | 36.86 |
| 2 (CH2) | 34.39 |
| 3 (C) | 215.18 |
| 4 (C) | 47.52 |
| 5 (CH) | 51.11 |
| 6 (CH2) | 23.92 |
| 7 (CH) | 120.43 |
| 8 (C) | 143.14 |
| 9 (C) | 146.97 |
| 10 (C) | 37.13 |
| 11 (CH) | 117.69 |
| 12 (CH2) | 37.5 |
| 13 (C) | 44.08 |
| 14 (C) | 50.6 |
| 15 (CH2) | 31.39 |
| 16 (CH2) | 28.14 |
| 17 (CH) | 51.11 |
| 18 (CH3) | 16.06 |
| 19 (CH3) | 22.11 |
| 20 (CH) | 36.55 |
| 21 (CH3) | 19.06 |
| 22 (CH2) | 34.39 |
| 23 (CH2) | 28.94 |
| 24 (CH) | 77.24 |
| 25 (C) | 74.79 |
| 26 (CH2) | 69.28 |
| 27 (CH3) | 20.14 |
| 28 (CH3) | 25.66 |
| 29 (CH3) | 22.39 |
| 30 (CH3) | 25.66 |
