Common Name: 2'R-Cipadesin A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C32H42O9/c1-8-16(2)28(36)40-26-23-24(35)31(6,19(29(26,3)4)13-21(33)37-7)18-9-11-30(5)20(32(18)27(23)41-32)14-22(34)39-25(30)17-10-12-38-15-17/h10,12,15-16,18-20,23,25-27H,8-9,11,13-14H2,1-7H3/t16-,18-,19+,20?,23+,25+,26-,27-,30-,31-,32-/m1/s1
InChIKey: InChIKey=JFCFHKVHDISZHG-YTZPLHCSSA-N
Formula: C32H42O9
Molecular Weight: 570.671705
Exact Mass: 570.282883
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Gan, L.S., Wang, X.N., Wu, Y., Yue, J.M. J Nat Prod (2007) 70, 1344-7
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Limonoids; 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 (C) | 214.2 |
2 (CH) | 48.8 |
3 (CH) | 76.8 |
4 (C) | 39.2 |
5 (CH) | 42.5 |
6 (CH2) | 33.1 |
7 (C) | 174.2 |
8 (C) | 60.6 |
9 (CH) | 55.9 |
10 (C) | 48.2 |
11 (CH2) | 19.3 |
12 (CH2) | 33.4 |
13 (C) | 36.4 |
14 (CH) | 45.9 |
15 (CH2) | 34 |
16 (C) | 172 |
17 (CH) | 78.9 |
18 (CH3) | 26.4 |
19 (CH3) | 15.9 |
20 (C) | 120.1 |
21 (CH) | 141 |
22 (CH) | 110.3 |
23 (CH) | 143.1 |
28 (CH3) | 20.9 |
29 (CH3) | 22.6 |
30 (CH) | 63.3 |
3a (C) | 175.7 |
3b (CH) | 41.2 |
3c (CH2) | 26.9 |
3d (CH3) | 16.7 |
3e (CH3) | 11.6 |
7a (CH3) | 52.3 |