Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C35H52O6/c1-20-12-13-35(31(38)39-9)15-14-32(4,5)18-26(35)25(20)17-24-16-23-10-11-28-33(6,7)30(41-22(3)37)27(40-21(2)36)19-34(28,8)29(23)24/h24,26-28,30H,10-19H2,1-9H3/t24?,26-,27+,28-,30-,34-,35+/m0/s1

InChIKey: InChIKey=PYKYRCINTSVNLL-PITAIESZSA-N

Formula: C35H52O6

Molecular Weight: 568.785105

Exact Mass: 568.376389

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Garcia-Granados, A., Lopez, P.E., Melguizo, E., Parra, A., Simeo, Y. Tetrahedron (2004) 60, 1491-503

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) 40
2 (CH) 70.1
3 (CH) 80.9
4 (C) 37.7
5 (CH) 51.1
6 (CH2) 19.3
7 (CH2) 34.5
8 (C) 136.8
9 (C) 152.8
10 (C) 39.5
11 (CH) 38.9
12 (CH2) 34
13 (C) 132.8
14 (C) 125.4
15 (CH2) 26.6
16 (CH2) 22.6
17 (C) 45.8
18 (CH) 35.2
19 (CH2) 41.9
20 (C) 30.8
21 (CH2) 29.9
22 (CH2) 32.2
23 (CH3) 28.3
24 (CH3) 17.3
25 (CH3) 21
26 (CH2) 35.3
27 (CH3) 19.6
28 (C) 178.4
29 (CH3) 32.9
30 (CH3) 24.3
2a (C) 170.7
2b (CH3) 21
3a (C) 170.8
3b (CH3) 21.3
28a (CH3) 51.6