Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H40O6/c1-17(31)35-25-15-24(33)29(6)22-10-12-28(5)20(19-11-13-34-16-19)8-9-21(28)30(22,7)26(36-18(2)32)14-23(29)27(25,3)4/h9,11,13,16,20,22-23,25-26H,8,10,12,14-15H2,1-7H3/t20-,22+,23-,25+,26+,28-,29+,30-/m0/s1
InChIKey: InChIKey=YNLJMEXIFXPJAS-NBJNSXDLSA-N
Formula: C30H40O6
Molecular Weight: 496.636137
Exact Mass: 496.282489
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rodriguez, B. Magn Reson Chem (2003) 41, 206-12
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) | 211.41 |
2 (CH2) | 39.26 |
3 (CH) | 80.49 |
4 (C) | 36.71 |
5 (CH) | 44.84 |
6 (CH2) | 23.24 |
7 (CH) | 74.68 |
8 (C) | 42.12 |
9 (CH) | 36.67 |
10 (C) | 52.34 |
11 (CH2) | 18.23 |
12 (CH2) | 33.76 |
13 (C) | 47.02 |
14 (C) | 158.99 |
15 (CH) | 119.26 |
16 (CH2) | 34.27 |
17 (CH) | 51.73 |
18 (CH3) | 21.88 |
19 (CH3) | 15.18 |
20 (C) | 124.77 |
21 (CH) | 139.6 |
22 (CH) | 111.06 |
23 (CH) | 142.5 |
28 (CH3) | 26.7 |
29 (CH3) | 21.83 |
30 (CH3) | 27.26 |
3a (C) | 170.32 |
3b (CH3) | 21.07 |
7a (C) | 170.18 |
7b (CH3) | 21.13 |