Spektraris NMR
3b,17b-Dihydroxy-28-norolean-12-ene
Common Name: 3b,17b-Dihydroxy-28-norolean-12-ene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C29H48O2/c1-24(2)14-16-29(31)17-15-27(6)19(20(29)18-24)8-9-22-26(5)12-11-23(30)25(3,4)21(26)10-13-28(22,27)7/h8,20-23,30-31H,9-18H2,1-7H3/t20-,21-,22+,23-,26-,27+,28+,29-/m0/s1
InChIKey: InChIKey=GYCWITAVSTXNTP-VSQYQUPVSA-N
Formula: C29H48O2
Molecular Weight: 428.691307
Exact Mass: 428.365431
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Linde H. Arch Pharm (1979) 312, 416
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) | 38.6 |
| 2 (CH2) | 27.3 |
| 3 (CH) | 79 |
| 4 (C) | 38.8 |
| 5 (CH) | 55.3 |
| 6 (CH2) | 18.4 |
| 7 (CH2) | 32.8 |
| 8 (C) | 39.7 |
| 9 (CH) | 47.7 |
| 10 (C) | 36.9 |
| 11 (CH2) | 23.7 |
| 12 (CH) | 124.3 |
| 13 (C) | 143.3 |
| 14 (C) | 41.6 |
| 15 (CH2) | 27.9 |
| 16 (CH2) | 25.5 |
| 17 (C) | 72.1 |
| 18 (CH) | 48.9 |
| 19 (CH2) | 48.4 |
| 20 (C) | 31 |
| 21 (CH2) | 36.6 |
| 22 (CH2) | 37.1 |
| 23 (CH3) | 28.2 |
| 24 (CH3) | 15.3 |
| 25 (CH3) | 15.6 |
| 26 (CH3) | 17.2 |
| 27 (CH3) | 25.5 |
| 29 (CH3) | 32.8 |
| 30 (CH3) | 23.9 |
