Spektraris NMR
23-Hydroxy-beta-amyrin
Common Name: 23-Hydroxy-beta-amyrin
Synonyms: 23-Hydroxy-beta-amyrin
CAS Registry Number:
InChI: InChI=1S/C30H50O2/c1-25(2)14-15-26(3)16-17-29(6)20(21(26)18-25)8-9-23-27(4)12-11-24(32)28(5,19-31)22(27)10-13-30(23,29)7/h8,21-24,31-32H,9-19H2,1-7H3/t21-,22+,23+,24-,26+,27-,28-,29+,30+/m0/s1
InChIKey: InChIKey=NTWLPZMPTFQYQI-OSKQWRSTSA-N
Formula: C30H50O2
Molecular Weight: 442.717924
Exact Mass: 442.381081
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wang, K.W., Sun, H.X., Wu, B., Pan, Y.J. Helv Chim Acta (2005) 88, 990-5
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) | 38.5 |
| 2 (CH2) | 27.4 |
| 3 (CH) | 77.7 |
| 4 (C) | 42.1 |
| 5 (CH) | 50 |
| 6 (CH2) | 18.8 |
| 7 (CH2) | 32.7 |
| 8 (C) | 40 |
| 9 (CH) | 47.9 |
| 10 (C) | 37.1 |
| 11 (CH2) | 23.7 |
| 12 (CH) | 121.9 |
| 13 (C) | 145.4 |
| 14 (C) | 42 |
| 15 (CH2) | 27.1 |
| 16 (CH2) | 26.4 |
| 17 (C) | 32.7 |
| 18 (CH) | 47.3 |
| 19 (CH2) | 47.1 |
| 20 (C) | 31.3 |
| 21 (CH2) | 35 |
| 22 (CH2) | 37.4 |
| 23 (CH2) | 72.5 |
| 24 (CH3) | 11.6 |
| 25 (CH3) | 16.1 |
| 26 (CH3) | 17.1 |
| 27 (CH3) | 26.2 |
| 28 (CH3) | 28.6 |
| 29 (CH3) | 33.6 |
| 30 (CH3) | 23.9 |
