Spektraris NMR
(23Z)-3β.Acetoxyeupha-7,23-dien-2S-ol
Common Name: (23Z)-3β.Acetoxyeupha-7,23-dien-2S-ol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C32H52O3/c1-21(11-10-17-28(3,4)34)23-14-19-32(9)25-12-13-26-29(5,6)27(35-22(2)33)16-18-30(26,7)24(25)15-20-31(23,32)8/h10,12,17,21,23-24,26-27,34H,11,13-16,18-20H2,1-9H3/b17-10+/t21-,23+,24+,26+,27+,30-,31+,32-/m1/s1
InChIKey: InChIKey=WBSWTRWRHYYJBZ-MDAHXEIOSA-N
Formula: C32H52O3
Molecular Weight: 484.754683
Exact Mass: 484.391646
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Kitajima, J., Kimizuka, K., Tanaka, Y. Chem Pharm Bull (1998) 46, 1408-11
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Euphanes; 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) | 36.83 |
| 2 (CH2) | 24.18 |
| 3 (CH) | 81.13 |
| 4 (C) | 37.83 |
| 5 (CH) | 50.75 |
| 6 (CH2) | 23.76 |
| 7 (CH) | 117.71 |
| 8 (C) | 145.83 |
| 9 (CH) | 48.79 |
| 10 (C) | 34.81 |
| 11 (CH2) | 18.14 |
| 12 (CH2) | 33.72 |
| 13 (C) | 43.57 |
| 14 (C) | 51.25 |
| 15 (CH2) | 33.92 |
| 16 (CH2) | 28.27 |
| 17 (CH) | 53.06 |
| 18 (CH3) | 22.19 |
| 19 (CH3) | 13.14 |
| 20 (CH) | 36.18 |
| 21 (CH3) | 18.8 |
| 22 (CH2) | 38 |
| 23 (CH) | 126.04 |
| 24 (CH) | 139.12 |
| 25 (C) | 70.74 |
| 26 (CH3) | 29.88 |
| 27 (CH3) | 29.93 |
| 28 (CH3) | 27.57 |
| 29 (CH3) | 15.87 |
| 30 (CH3) | 27.13 |
| 3a (C) | 171.02 |
| 3b (CH3) | 21.34 |
