25-O-Methoxyluffariellolide

25-O-Methoxyluffariellolide

Common Name: 25-O-Methoxyluffariellolide

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C26H40O3/c1-19(12-8-14-22-18-24(27)29-25(22)28-6)10-7-11-20(2)15-16-23-21(3)13-9-17-26(23,4)5/h11-12,18,25H,7-10,13-17H2,1-6H3/b19-12+,20-11+

InChIKey: InChIKey=PFOVLLSEYCTGAF-PFTXGBMHSA-N

Formula: C26H40O3

Molecular Weight: 400.594978

Exact Mass: 400.297745

NMR Solvent: CD3OD

MHz:

Calibration:

NMR references: 13C - Elkhayat, E., Edrada, R., Ebel, R., Wray, V., van Soest, R., Wiryowidagdo, S., Mohamed, M.H., Muller, W.E., Proksch, P. J Nat Prod (2004) 67, 1809-17

Species:

Notes: Family : Terpenoids, Type : Sesterterpenoids, Group : Monocarbocyclics; 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 (C) 172
2 (CH) 118.8
3 (C) 170
4 (CH2) 28.7
5 (CH2) 26.1
6 (CH) 124
7 (C) 138.2
8 (CH2) 40.7
9 (CH2) 27.4
10 (CH) 124.7
11 (C) 137.2
12 (CH2) 41.7
13 (CH2) 29.3
14 (C) 138.3
15 (C) 128.1
16 (CH2) 33.7
17 (CH2) 20.1
18 (CH2) 41.1
19 (C) 36.2
20 (CH3) 29.2
21 (CH3) 20.6
22 (CH3) 29.2
23 (CH3) 16.1
24 (CH3) 16.2
25 (CH) 106.3
25a (CH3) 57.3