Common Name: 3-O-R-L-rhamnopyranosyl-(1f6)-Ç-D-glucopyranosyljujubogenin-20-O-R-L-rhamnopyranoside
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C48H78O17/c1-21(2)16-24-17-46(9,65-42-38(57)34(53)31(50)23(4)61-42)39-25-10-11-28-44(7)14-13-29(43(5,6)27(44)12-15-45(28,8)47(25)19-48(39,64-24)59-20-47)63-41-37(56)35(54)32(51)26(62-41)18-58-40-36(55)33(52)30(49)22(3)60-40/h16,22-42,49-57H,10-15,17-20H2,1-9H3/t22-,23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,33+,34+,35-,36+,37+,38+,39-,40+,41-,42-,44-,45+,46-,47-,48-/m0/s1
InChIKey: InChIKey=JEKQVUNAHQYCDC-OONGKEQXSA-N
Formula: C48H78O17
Molecular Weight: 927.124586
Exact Mass: 926.523901
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Maciuk, A., Lavaud, C., Thepenier, P., Jacquier, M.J., Ghedira, K., Zeches-Hanrot, M. J Nat Prod (2004) 67, 1639-43
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Dammaranes; 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) | 39.6 |
2 (CH2) | 27.3 |
3 (CH) | 90.7 |
4 (C) | 40.3 |
5 (CH) | 57.2 |
6 (CH2) | 19.1 |
7 (CH2) | 36.7 |
8 (C) | 38.3 |
9 (CH) | 53.9 |
10 (C) | 38.4 |
11 (CH2) | 22.5 |
12 (CH2) | 29 |
13 (CH) | 37.8 |
14 (C) | 54.8 |
15 (CH2) | 37.7 |
16 (C) | 110.9 |
17 (CH) | 55.5 |
18 (CH2) | 66.9 |
19 (CH3) | 16.8 |
20 (C) | 76.9 |
21 (CH3) | 28.4 |
22 (CH2) | 41.4 |
23 (CH) | 69.5 |
24 (CH) | 125.9 |
25 (C) | 138 |
26 (CH3) | 25.7 |
27 (CH3) | 19 |
28 (CH3) | 30.8 |
29 (CH3) | 16.7 |
30 (CH3) | 19.7 |
1' (CH) | 106.8 |
2' (CH) | 75.6 |
3' (CH) | 78.2 |
4' (CH) | 71.7 |
5' (CH) | 76.4 |
6' (CH2) | 68.2 |
1'' (CH) | 102.2 |
2'' (CH) | 72.3 |
3'' (CH) | 72.4 |
4'' (CH) | 74 |
5'' (CH) | 69.8 |
6'' (CH3) | 18.1 |
1''' (CH) | 96.6 |
2''' (CH) | 73.6 |
3''' (CH) | 72.5 |
4''' (CH) | 73.6 |
5''' (CH) | 71.5 |
6''' (CH3) | 18.2 |