Spektraris NMR
Maytenfolone
Common Name: Maytenfolone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H46O3/c1-19-20(31)7-8-21-26(19,3)10-9-22-27(21,4)12-13-29(6)23-17-25(2)11-15-30(23,18-33-24(25)32)16-14-28(22,29)5/h19,21-23H,7-18H2,1-6H3/t19-,21+,22-,23-,25-,26+,27-,28+,29-,30+/m0/s1
InChIKey: InChIKey=SKTHBZAZNLILND-TXKVWOPDSA-N
Formula: C30H46O3
Molecular Weight: 454.685566
Exact Mass: 454.344695
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Kuo, Y.H., Kuo, L.M.Y. Phytochemistry (1997) 44, 1275-81
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Friedelanes; 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) | 22.22 |
| 2 (CH2) | 41.38 |
| 3 (C) | 212.8 |
| 4 (CH) | 58.12 |
| 5 (C) | 41.91 |
| 6 (CH2) | 41.01 |
| 7 (CH2) | 18.08 |
| 8 (CH) | 50.7 |
| 9 (C) | 37.71 |
| 10 (CH) | 59.36 |
| 11 (CH2) | 34.72 |
| 12 (CH2) | 28.28 |
| 13 (C) | 38.97 |
| 14 (C) | 38.47 |
| 15 (CH2) | 28.98 |
| 16 (CH2) | 29.54 |
| 17 (C) | 34.64 |
| 18 (CH) | 39.47 |
| 19 (CH2) | 33.2 |
| 20 (C) | 33.32 |
| 21 (CH2) | 30.03 |
| 22 (CH2) | 41.38 |
| 23 (CH3) | 6.77 |
| 24 (CH3) | 14.59 |
| 25 (CH3) | 18.09 |
| 26 (CH3) | 16.63 |
| 27 (CH3) | 15.23 |
| 28 (CH2) | 83.8 |
| 29 (C) | 180 |
| 30 (CH3) | 27.85 |
