Spektraris NMR
8(9)a-Epoxy-12,13-anhydrohypoestenone
Common Name: 8(9)a-Epoxy-12,13-anhydrohypoestenone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H26O3/c1-10(2)12-6-17(22)19(4)9-13-11(3)16(21)7-15(13)20(5)18(23-20)8-14(12)19/h6,10,14-15,18H,7-9H2,1-5H3/t14-,15-,18-,19+,20+/m1/s1
InChIKey: InChIKey=RZYUYVUZIAJOEP-LQQYDMKDSA-N
Formula: C20H26O3
Molecular Weight: 314.419392
Exact Mass: 314.188195
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - El Sayed, K.A. J Nat Prod (2001) 64, 373-5
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Fusicoccanes; 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) | 52.2 |
| 2 (CH2) | 34 |
| 3 (C) | 167.3 |
| 4 (C) | 141.6 |
| 5 (C) | 207.6 |
| 6 (CH2) | 36.4 |
| 7 (CH) | 45 |
| 8 (C) | 59.7 |
| 9 (CH) | 64.8 |
| 10 (CH2) | 23.1 |
| 11 (CH) | 52 |
| 12 (C) | 184 |
| 13 (CH) | 123.3 |
| 14 (C) | 209.3 |
| 15 (CH3) | 21.1 |
| 16 (CH3) | 8.6 |
| 17 (CH3) | 16.7 |
| 18 (CH) | 29.2 |
| 19 (CH3) | 20.3 |
| 20 (CH3) | 20.4 |
