3-(3-Methylbutanoyloxy)-9-hydroxy-14-(erythro-2-methyl-3-hydroxybutanoyloxy)-14,15-epoxytrix-5(15)-en-4,12-olide

3-(3-Methylbutanoyloxy)-9-hydroxy-14-(erythro-2-methyl-3-hydroxybutanoyloxy)-14,15-epoxytrix-5(15)-en-4,12-olide

Common Name: 3-(3-Methylbutanoyloxy)-9-hydroxy-14-(erythro-2-methyl-3-hydroxybutanoyloxy)-14,15-epoxytrix-5(15)-en-4,12-olide

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C25H34O9/c1-10(2)6-17(28)32-18-14-8-25-13-7-16(27)20(25)24(14,5)23(30)33-19(18)15(25)9-31-22(13)34-21(29)11(3)12(4)26/h9-14,16,18-20,22,26-27H,6-8H2,1-5H3/t11-,12+,13-,14-,16+,18-,19+,20-,22-,24+,25-/m0/s1

InChIKey: InChIKey=OXVCLSIGGRTSNI-BZRBUGBCSA-N

Formula: C25H34O9

Molecular Weight: 478.533027

Exact Mass: 478.220283

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Kotowicz, C., Hernandez, L.R., Cerda-Garcia-Rojas, C.M., Villecco, M.B., Catalan, C.A., Joseph-Nathan, P. J Nat Prod (2001) 64, 1326-31

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Miscellanea; 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) 41.9
2 (CH) 49.3
3 (CH) 74.1
4 (CH) 76.6
5 (C) 117.8
6 (C) 53.8
7 (CH) 40.5
8 (CH2) 40.9
9 (CH) 72.9
10 (CH) 61.8
11 (C) 49.8
12 (C) 177.2
13 (CH3) 20
14 (CH) 95.6
15 (CH) 139.9
3a (C) 172
3b (CH2) 43.2
3c (CH) 25.6
3d (CH3) 22.3
3e (CH3) 22.3
14a (C) 173.9
14b (CH) 45.8
14c (CH) 68.1
14ba (CH3) 10.8
14ca (CH3) 20.1