Spektraris NMR
(2S,4aalpha,8aalpha)-2beta,6beta-Diallyloctahydropyrano[3,2-b]pyran-3alpha,7alpha-diol
![(2S,4aalpha,8aalpha)-2beta,6beta-Diallyloctahydropyrano[3,2-b]pyran-3alpha,7alpha-diol](/nmr/static/nmr/svg/20028.svg)
Common Name: (2S,4aalpha,8aalpha)-2beta,6beta-Diallyloctahydropyrano[3,2-b]pyran-3alpha,7alpha-diol
Synonyms: (2S,4aalpha,8aalpha)-2beta,6beta-Diallyloctahydropyrano[3,2-b]pyran-3alpha,7alpha-diol
CAS Registry Number:
InChI: InChI=1S/C14H22O4/c1-3-5-11-9(15)7-14-13(17-11)8-10(16)12(18-14)6-4-2/h3-4,9-16H,1-2,5-8H2/t9-,10-,11+,12+,13-,14-/m1/s1
InChIKey: InChIKey=ZJFHZGZENDFVOJ-UYYXNEDZSA-N
Formula: C14H22O4
Molecular Weight: 254.322619
Exact Mass: 254.151809
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Sheldrake, H.M., Jamieson, C., Burton, J.W. Angew Chem Int Ed (2006) 45, 7199-202
Species:
Notes: Family : Polyketides, Type : Acetogenins; 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 |
|---|---|
| 3 (CH2) | 116.7 |
| 4 (CH) | 135.1 |
| 5 (CH2) | 36.7 |
| 6 (CH) | 81 |
| 7 (CH) | 66.1 |
| 8 (CH2) | 37.7 |
| 9 (CH) | 73.6 |
| 10 (CH) | 73.6 |
| 11 (CH2) | 37.7 |
| 12 (CH) | 66.1 |
| 13 (CH) | 81 |
| 14 (CH2) | 36.7 |
| 15 (CH) | 135.1 |
| 16 (CH2) | 116.7 |
