Spektraris NMR
δ_Amyrone
Common Name: δ_Amyrone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H48O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h22-23H,9-19H2,1-8H3/t22-,23+,27+,28-,29+,30+/m0/s1
InChIKey: InChIKey=KPUDOJPVQQJLGI-CKARLABJSA-N
Formula: C30H48O1
Molecular Weight: 424.702638
Exact Mass: 424.370516
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - He, A.M., Wang, M.S., Hao, H.Y., Zhang, D.C., Lee, K.H. Phytochemistry (1998) 49, 2607-10
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Oleananes; 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) | 39.3 |
| 2 (CH2) | 34.1 |
| 3 (C) | 218.2 |
| 4 (C) | 47.2 |
| 5 (CH) | 54.8 |
| 6 (CH2) | 19.8 |
| 7 (CH2) | 26.5 |
| 8 (C) | 40.9 |
| 9 (CH) | 50 |
| 10 (C) | 36.9 |
| 11 (CH2) | 22.2 |
| 12 (CH2) | 26.5 |
| 13 (C) | 134.1 |
| 14 (C) | 44.7 |
| 15 (CH2) | 25 |
| 16 (CH2) | 36.5 |
| 17 (C) | 34.5 |
| 18 (C) | 133.6 |
| 19 (CH2) | 39.6 |
| 20 (C) | 33.3 |
| 21 (CH2) | 35.3 |
| 22 (CH2) | 38.7 |
| 23 (CH3) | 26.5 |
| 24 (CH3) | 21.3 |
| 25 (CH3) | 36.3 |
| 26 (CH3) | 17.6 |
| 27 (CH3) | 21.2 |
| 28 (CH3) | 24.1 |
| 29 (CH3) | 23.8 |
| 30 (CH3) | 32.3 |
