Spektraris NMR
3-Epi-δ-amyrin
Common Name: 3-Epi-δ-amyrin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H50O/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/h22-24,31H,9-19H2,1-8H3/t22-,23+,24+,27+,28-,29+,30+/m0/s1
InChIKey: InChIKey=JOCIRBSYAYKMEF-HJNBUTKPSA-N
Formula: C30H50O1
Molecular Weight: 426.71852
Exact Mass: 426.386166
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) | 33.6 |
| 2 (CH2) | 25.5 |
| 3 (CH) | 76.3 |
| 4 (C) | 37.6 |
| 5 (CH) | 49.2 |
| 6 (CH2) | 18.5 |
| 7 (CH2) | 34.8 |
| 8 (C) | 41.4 |
| 9 (CH) | 50.7 |
| 10 (C) | 37.5 |
| 11 (CH2) | 21.7 |
| 12 (CH2) | 26.6 |
| 13 (C) | 134.6 |
| 14 (C) | 44.9 |
| 15 (CH2) | 25.2 |
| 16 (CH2) | 36.8 |
| 17 (C) | 34.7 |
| 18 (C) | 133.1 |
| 19 (CH2) | 39.5 |
| 20 (C) | 33.4 |
| 21 (CH2) | 35.6 |
| 22 (CH2) | 38.7 |
| 23 (CH3) | 28.3 |
| 24 (CH3) | 22.3 |
| 25 (CH3) | 16.2 |
| 26 (CH3) | 17.7 |
| 27 (CH3) | 21.6 |
| 28 (CH3) | 24.2 |
| 29 (CH3) | 23.9 |
| 30 (CH3) | 32.4 |
