Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C28H34O10/c1-13(29)34-17-12-16-24(2,3)37-18(30)8-9-25(16,4)15-7-10-26(5)20(14-11-19(31)35-22(14)32)36-23(33)21-28(26,38-21)27(15,17)6/h8-9,11,15-17,20-22,32H,7,10,12H2,1-6H3/t15-,16+,17+,20+,21-,22?,25-,26+,27+,28-/m1/s1
InChIKey: InChIKey=VKZYANGAHYJBJK-UDLZMHCKSA-N
Formula: C28H34O10
Molecular Weight: 530.56464
Exact Mass: 530.215197
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Garcez, F.R., Garcez, W.S., Roque, N.F., Castellano, E.E., Zukerman-Schpector, J. Phytochemistry (2000) 55, 733-40
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) | 157.7 |
2 (CH) | 122.7 |
3 (C) | 167.5 |
4 (C) | 84.8 |
5 (CH) | 54.7 |
6 (CH2) | 30.2 |
7 (CH) | 75.4 |
8 (C) | 44.3 |
9 (CH) | 48.3 |
10 (C) | 42.9 |
11 (CH2) | 19.5 |
12 (CH2) | 32.3 |
13 (C) | 38.9 |
14 (C) | 67.3 |
15 (CH) | 51 |
16 (C) | 165.8 |
17 (CH) | 78.5 |
18 (CH3) | 21.7 |
19 (CH3) | 16.3 |
20 (C) | 162.7 |
21 (CH) | 97.6 |
22 (CH) | 123.4 |
23 (C) | 168.9 |
28 (CH3) | 32.3 |
29 (CH3) | 26.9 |
30 (CH3) | 12.1 |
7a (C) | 170.4 |
7b (CH3) | 21.2 |