Spektraris NMR
Ophioglonol prenyl ether
Common Name: Ophioglonol prenyl ether
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H20O7/c1-11(2)5-6-27-10-14-20(26)19-17(25)8-13(22)9-18(19)28-21(14)12-3-4-15(23)16(24)7-12/h3-5,7-9,22-25H,6,10H2,1-2H3
InChIKey: InChIKey=CBVYNPBPPIHKOV-UHFFFAOYSA-N
Formula: C21H20O7
Molecular Weight: 384.380103
Exact Mass: 384.120903
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Lin, Y.L., Shen, C.C., Huang, Y.J., Chang, Y.Y. J Nat Prod (2005) 68, 381-4
Species:
Notes: Family : Flavonoids, Type : Rotenoids; 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 |
|---|---|
| 2 (C) | 165.4 |
| 3 (C) | 114.2 |
| 4 (C) | 181.1 |
| 5 (C) | 161.5 |
| 6 (CH) | 99 |
| 7 (C) | 165.5 |
| 8 (CH) | 93.8 |
| 9 (C) | 157.2 |
| 10 (C) | 102.6 |
| 1' (C) | 122.3 |
| 2' (CH) | 115.9 |
| 3' (C) | 145.4 |
| 4' (C) | 149.2 |
| 5' (CH) | 115.3 |
| 6' (CH) | 121.2 |
| 3a (CH2) | 61.8 |
| 3b (CH2) | 66.4 |
| 3c (CH) | 121.4 |
| 3d (C) | 135.9 |
| 3e (CH3) | 25.5 |
| 3da (CH3) | 17.8 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.