Spektraris NMR
Acalycixeniolide C
Common Name: Acalycixeniolide C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H26O3/c1-4-5-6-7-15-14-10-11-19(3)17(22-19)9-8-13(2)16(14)12-21-18(15)20/h5,14-17H,1-2,6-12H2,3H3/t14-,15+,16+,17+,19+/m1/s1
InChIKey: InChIKey=DQTYNKVIRJYJRR-QSUVVDIXSA-N
Formula: C19H26O3
Molecular Weight: 302.408656
Exact Mass: 302.188195
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) | 150.6 |
| 2 (CH) | 48.6 |
| 3 (CH) | 44.6 |
| 4 (CH2) | 28.6 |
| 5 (CH2) | 39.7 |
| 6 (C) | 59.1 |
| 7 (CH) | 61.8 |
| 8 (CH2) | 25.2 |
| 9 (CH2) | 33.6 |
| 10 (CH) | 41.2 |
| 11 (CH2) | 26 |
| 12 (CH2) | 25.7 |
| 13 (CH) | 89 |
| 14 (C) | 208.5 |
| 15 (CH2) | 75.5 |
| 17 (C) | 174.9 |
| 18 (CH2) | 70.7 |
| 19 (CH2) | 113.8 |
| 20 (CH3) | 16.2 |
