Common Name: Tuxpanolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O5/c1-13(2)12-18-19(23)16(20(24)25-18)8-9-17(22)15(4)7-5-6-14(3)10-11-21/h7-8,10,12,17-19,21-23H,5-6,9,11H2,1-4H3/b14-10-,15-7+,16-8+/t17?,18-,19+/m1/s1
InChIKey: InChIKey=XTDIHRJVDHZHKP-RJLCEXFASA-N
Formula: C20H30O5
Molecular Weight: 350.449965
Exact Mass: 350.209324
NMR Solvent: C+B
MHz:
Calibration:
NMR references: 13C - Maldonado, E., Bello, M., Villasenor, J.L., Ortega, A. Phytochemistry (1998) 49, 1115-8
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Phytanes; 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) | 58.3 |
2 (CH) | 124.8 |
3 (C) | 137.1 |
4 (CH2) | 30.8 |
5 (CH2) | 24.7 |
6 (CH) | 125.3 |
7 (C) | 137.1 |
8 (CH) | 73.7 |
9 (CH2) | 35.3 |
10 (CH) | 142 |
11 (C) | 132.7 |
12 (CH) | 70.9 |
13 (CH) | 82.7 |
14 (CH) | 121.1 |
15 (C) | 139.4 |
16 (CH3) | 25.1 |
17 (CH3) | 17.9 |
18 (C) | 169.7 |
19 (CH3) | 11.3 |
20 (CH3) | 22.8 |