Spektraris NMR
20-Hydroxylucidenic acid P
Common Name: 20-Hydroxylucidenic acid P
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C34H56O5/c1-21(35)38-20-34-17-14-27(39-22(2)36)29(3,4)25(34)13-16-33(9)26(34)11-10-24-28-23(30(5,6)37)12-15-31(28,7)18-19-32(24,33)8/h23-28,37H,10-20H2,1-9H3/t23-,24-,25+,26+,27+,28-,31-,32-,33-,34-/m1/s1
InChIKey: InChIKey=XIHXGVYZKINDEK-OPKHDCNBSA-N
Formula: C34H56O5
Molecular Weight: 544.806727
Exact Mass: 544.412775
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Yuruker, A., Orjala, J., Sticher, O., Rali, T. Phytochemistry (1998) 48, 863-6
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Lupanes; 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) | 33.4 |
| 2 (CH2) | 23.6 |
| 3 (CH) | 80.5 |
| 4 (C) | 37.5 |
| 5 (CH) | 55.5 |
| 6 (CH2) | 18 |
| 7 (CH2) | 34.5 |
| 8 (C) | 40.1 |
| 9 (CH) | 51 |
| 10 (C) | 41.4 |
| 11 (CH2) | 23.9 |
| 12 (CH2) | 28.7 |
| 13 (CH) | 37.6 |
| 14 (C) | 43.9 |
| 15 (CH2) | 27.8 |
| 16 (CH2) | 35.6 |
| 17 (C) | 44.5 |
| 18 (CH) | 48.4 |
| 19 (CH) | 50 |
| 20 (C) | 73.4 |
| 21 (CH2) | 29.4 |
| 22 (CH2) | 40.1 |
| 23 (CH3) | 28.6 |
| 24 (CH3) | 16.9 |
| 25 (CH2) | 64 |
| 26 (CH3) | 16.5 |
| 27 (CH3) | 15.2 |
| 28 (CH3) | 19.2 |
| 29 (CH3) | 24.7 |
| 30 (CH3) | 31.7 |
| 3a (C) | 171.1 |
| 3b (CH3) | 21.3 |
| 25a (C) | 171 |
| 25b (CH3) | 21 |
