Spektraris NMR
Mucronulatol
Common Name: Mucronulatol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H18O5/c1-20-14-6-5-13(17(21-2)16(14)19)11-7-10-3-4-12(18)8-15(10)22-9-11/h3-6,8,11,18-19H,7,9H2,1-2H3/t11-/m1/s1
InChIKey: InChIKey=NUNFZNIXYWTZMW-LLVKDONJSA-N
Formula: C17H18O5
Molecular Weight: 302.322468
Exact Mass: 302.115424
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Hamburger, M.O., Cordell, G.A., Tantivatana, P., Ruangrungsi, N. J Nat Prod (1987) 50, 696-9
Species:
Notes: Family : Flavonoids, Type : Isoflavonoids, Group : Isoflavanones; 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 (CH2) | 69.7 |
| 3 (CH) | 31.3 |
| 4 (CH2) | 30.8 |
| 5 (CH) | 130.1 |
| 6 (CH) | 107.9 |
| 7 (C) | 156.5 |
| 8 (CH) | 102.5 |
| 9 (C) | 154.5 |
| 10 (C) | 112.7 |
| 1' (C) | 116.2 |
| 2' (C) | 146 |
| 3' (C) | 139.2 |
| 4' (C) | 147.7 |
| 5' (CH) | 107.5 |
| 6' (CH) | 126.8 |
| 2'a (CH3) | 55.9 |
| 4'a (CH3) | 60.3 |
