Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C37H56O8/c1-22(38)43-21-34(7)28-13-14-36(9)29(33(28,6)20-27(44-23(2)39)30(34)45-24(3)40)12-11-25-26-19-32(4,5)15-17-37(26,31(41)42-10)18-16-35(25,36)8/h11,26-30H,12-21H2,1-10H3/t26-,27+,28+,29+,30+,33-,34+,35+,36+,37-/m0/s1
InChIKey: InChIKey=DJMUBVMFYRJRMK-SMQXTKAASA-N
Formula: C37H56O8
Molecular Weight: 628.83715
Exact Mass: 628.397519
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Goulart, M.O.F., Santana, A.E.G., Alves, R.J., Desouza, J.D., Maia, J.G.S., Deoliveira, G.G., Deoliveira, A.B. Phytochemistry (1994) 37, 1139-42
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) | 38.5 |
2 (CH) | 67.7 |
3 (CH) | 72.4 |
4 (C) | 41.6 |
5 (CH) | 50.1 |
6 (CH2) | 18 |
7 (CH2) | 32.5 |
8 (C) | 39.3 |
9 (CH) | 47.5 |
10 (C) | 38.1 |
11 (CH2) | 23.5 |
12 (CH) | 121.8 |
13 (C) | 143.8 |
14 (C) | 42 |
15 (CH2) | 27.5 |
16 (CH2) | 22.9 |
17 (C) | 46.5 |
18 (CH) | 41.1 |
19 (CH2) | 45.8 |
20 (C) | 30.6 |
21 (CH2) | 33.7 |
22 (CH2) | 32.2 |
23 (CH3) | 22.1 |
24 (CH2) | 66.1 |
25 (CH3) | 16.6 |
26 (CH3) | 16.7 |
27 (CH3) | 25.9 |
28 (C) | 178.1 |
29 (CH3) | 33 |
30 (CH3) | 23.5 |
2a (C) | 171.1 |
2b (CH3) | 21.1 |
3a (C) | 170.3 |
3b (CH3) | 20.8 |
24a (C) | 170.1 |
24b (CH3) | 20.9 |
28a (CH3) | 51.5 |