Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H50O3/c1-22(2)11-8-19-30(7)28(33-30)17-14-23(3)12-9-18-29(6)25(5)15-16-26(24(4)21-32)27(29)13-10-20-31/h11-12,21,25,27-28,31H,8-10,13-20H2,1-7H3/b23-12+,26-24-/t25-,27-,28?,29-,30?/m1/s1
InChIKey: InChIKey=KWJCZFYAVGCCMW-UKVGCDMVSA-N
Formula: C30H50O3
Molecular Weight: 458.717329
Exact Mass: 458.375995
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Bonfils, J.P., Marner, F.J., Sauvaire, Y. Phytochemistry (1998) 48, 75
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Iridals; 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)
Position | PPM |
---|---|
1 (CH) | 189.9 |
2 (C) | 133.3 |
3 (CH2) | 62.9 |
4 (CH2) | 31.5 |
5 (CH2) | 24 |
6 (CH) | 43.3 |
7 (C) | 163.3 |
8 (CH2) | 27.4 |
9 (CH2) | 30.5 |
10 (CH) | 35.7 |
11 (C) | 40.1 |
12 (CH2) | 31.7 |
13 (CH2) | 21.1 |
14 (CH) | 124.9 |
15 (C) | 134.3 |
16 (CH2) | 36.3 |
17 (CH2) | 27.2 |
18 (CH) | 63.4 |
19 (C) | 60.8 |
20 (CH2) | 38.8 |
21 (CH2) | 23.8 |
22 (CH) | 123.7 |
23 (C) | 131.8 |
24 (CH3) | 25.7 |
25 (CH3) | 10.8 |
26 (CH3) | 24.2 |
27 (CH3) | 15.2 |
28 (CH3) | 15.9 |
29 (CH3) | 16.5 |
30 (CH3) | 17.7 |