Spektraris NMR
Acalycixeniolide F
Common Name: Acalycixeniolide F
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O3/c1-13(2)6-5-7-16-15-10-11-20(4)18(23-20)9-8-14(3)17(15)12-22-19(16)21/h6,15-18H,3,5,7-12H2,1-2,4H3/t15-,16+,17+,18+,20+/m1/s1
InChIKey: InChIKey=AXWUMLHVVOTAIO-NSOKGPEJSA-N
Formula: C20H30O3
Molecular Weight: 318.451155
Exact Mass: 318.219495
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rho, J.R., Lee, H.S., Seo, Y., Cho, K.W., Shin, J. J Nat Prod (2000) 63, 254-7
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Xenicanes; 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) | 150.7 |
| 2 (CH) | 48.5 |
| 3 (CH) | 44.4 |
| 4 (CH2) | 28.5 |
| 5 (CH2) | 39.8 |
| 6 (C) | 59.1 |
| 7 (CH) | 61.9 |
| 8 (CH2) | 25.3 |
| 9 (CH2) | 33.6 |
| 10 (CH) | 41.3 |
| 11 (CH2) | 26.8 |
| 12 (CH2) | 25.3 |
| 13 (CH) | 123.2 |
| 14 (C) | 133 |
| 15 (CH3) | 17.9 |
| 16 (CH3) | 25.8 |
| 17 (C) | 175 |
| 18 (CH2) | 70.7 |
| 19 (CH2) | 113.6 |
| 20 (CH3) | 16.2 |
