Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C29H48O4/c1-25(2)14-18-17(13-24(25)33)20(31)15-29(6)19(18)7-8-22-26(3)11-10-23(32)27(4,16-30)21(26)9-12-28(22,29)5/h7,17-18,20-24,30-33H,8-16H2,1-6H3/t17?,18-,20-,21-,22-,23+,24+,26+,27+,28-,29-/m1/s1
InChIKey: InChIKey=LUBKGDDSWFTQEH-YIVWLQRFSA-N
Formula: C29H48O4
Molecular Weight: 460.690117
Exact Mass: 460.35526
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Chang I. S., Han Y. B. , Woo W. S., Kang S. S., Lotter H., Wagner H. Planta Med (1989) 55, 544
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)
Position | PPM |
---|---|
1 (CH2) | 37.7 |
2 (CH2) | 23 |
3 (CH) | 74.5 |
4 (C) | 40.7 |
5 (CH) | 48.3 |
6 (CH2) | 18.1 |
7 (CH2) | 32.4 |
8 (C) | 34.2 |
9 (CH) | 47.1 |
10 (C) | 37 |
11 (CH2) | 23.3 |
12 (CH) | 118.3 |
13 (C) | 143 |
14 (C) | 42.4 |
15 (CH2) | 33.3 |
16 (CH) | 74.6 |
17 (CH) | 39.8 |
18 (CH) | 35.8 |
19 (CH2) | 44.8 |
20 (C) | 34.7 |
21 (CH) | 78.2 |
22 (CH2) | 32.8 |
23 (CH2) | 65.5 |
24 (CH3) | 12.9 |
25 (CH3) | 15.8 |
26 (CH3) | 16.8 |
27 (CH3) | 26.2 |
29 (CH3) | 18.9 |
30 (CH3) | 19.3 |