Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H52O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h19-25,31H,9-18H2,1-8H3/t19-,20+,21-,22+,23-,24+,25+,27-,28+,29-,30-/m1/s1
InChIKey: InChIKey=QMKPCZNFLUQTJZ-AQFLWIPMSA-N
Formula: C30H52O1
Molecular Weight: 428.734401
Exact Mass: 428.401816
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Lima, M.D., Braga, P.A.D., Macedo, M.L., da Silva, M., Ferreira, A.G., Fernandes, J.B., Vieira, P.C. J Braz Chem Soc (2004) 15, 385-94
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Ursanes; 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 (CH2) | 38.7 |
2 (CH2) | 27.2 |
3 (CH) | 78.3 |
4 (C) | 38.7 |
5 (CH) | 55.2 |
6 (CH2) | 18.3 |
7 (CH2) | 32.9 |
8 (C) | 40 |
9 (CH) | 47.7 |
10 (C) | 36.9 |
11 (CH2) | 23.3 |
12 (CH2) | 124.3 |
13 (CH) | 139.3 |
14 (C) | 42 |
15 (CH2) | 28.7 |
16 (CH2) | 26.6 |
17 (C) | 33.7 |
18 (CH) | 58.9 |
19 (CH) | 39.6 |
20 (CH) | 39.6 |
21 (CH2) | 31.2 |
22 (CH2) | 41.5 |
23 (CH3) | 28.1 |
24 (CH3) | 15.6 |
25 (CH3) | 15.6 |
26 (CH3) | 16.8 |
27 (CH3) | 23.3 |
28 (CH3) | 28.1 |
29 (CH3) | 17.4 |
30 (CH3) | 21.3 |