Tuxpanolide

Tuxpanolide

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: CDCl3

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)

Carbon NMR Peaks

Position PPM
1 (CH2) 58.9
2 (CH) 124.7
3 (C) 138.1
4 (CH2) 31.1
5 (CH2) 24.9
6 (CH) 125.8
7 (C) 137.4
8 (CH) 73.9
9 (CH2) 35.7
10 (CH) 142
11 (C) 133.3
12 (CH) 71.1
13 (CH) 82.9
14 (CH) 121
15 (C) 140.1
16 (CH3) 25.7
17 (CH3) 18.6
18 (C) 170
19 (CH3) 11.8
20 (CH3) 23.3