Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C27H30O10/c1-23(2)15-10-16(29)25(4)18(26(15,22(32)37-23)8-6-17(30)33-5)14(28)11-24(3)19(13-7-9-34-12-13)35-21(31)20-27(24,25)36-20/h6-9,12,14-15,18-20,28H,10-11H2,1-5H3/b8-6-/t14-,15+,18+,19+,20-,24+,25-,26+,27-/m1/s1
InChIKey: InChIKey=KDBSGDOGSZCQHJ-TWCLLZRXSA-N
Formula: C27H30O10
Molecular Weight: 514.522141
Exact Mass: 514.183897
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ribeiro, T.A.N., Ndiaye, E.A.D., Velozo, E.D., Vieira, P.C., Ellena, J., de Sousa, P.T. J. Braz. Chem. Soc. (2005) 16, 1347-52
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 (CH) | 151.6 |
2 (CH) | 123.2 |
3 (C) | 165.5 |
4 (C) | 87.6 |
5 (CH) | 49.9 |
6 (CH2) | 38.1 |
7 (C) | 207.3 |
8 (C) | 48.5 |
9 (CH) | 43.9 |
10 (C) | 53.6 |
11 (CH) | 66.4 |
12 (CH2) | 41.2 |
13 (C) | 36.5 |
14 (C) | 65.1 |
15 (CH) | 52.6 |
16 (C) | 166.9 |
17 (CH) | 77.8 |
18 (CH3) | 19.2 |
19 (C) | 182.5 |
20 (C) | 120.1 |
21 (CH) | 141.1 |
22 (CH) | 109.9 |
23 (CH) | 142.9 |
28 (CH3) | 32.4 |
29 (CH3) | 24.4 |
30 (CH3) | 16.7 |
3a (CH3) | 52.3 |