Spektraris NMR
Woodwardine
Common Name: Woodwardine
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H34O4/c1-15(2)8-6-9-16(3)10-7-11-22(5)14-18(23)12-17(4)21(22)19(24)13-20(25)26/h7-8,10-11,18-19,23-24H,6,9,12-14H2,1-5H3,(H,25,26)/b11-7+,16-10+/t18-,19-,22+/m0/s1
InChIKey: InChIKey=OGXRBXPEGCXCCR-UZIIXKGZSA-N
Formula: C22H34O4
Molecular Weight: 362.503795
Exact Mass: 362.24571
NMR Solvent: P+M
MHz:
Calibration:
NMR references: 13C - Hanus, L.O., Rezanka, T., Dembitsky, V.M. Phytochemistry (2003) 63, 869-75
Species:
Notes: Family : Terpenoids, Type : Sesterterpenoids, Group : Monocarbocyclics; 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) | 177 |
| 2 (CH2) | 42.2 |
| 3 (CH) | 60.7 |
| 4 (C) | 138.5 |
| 5 (C) | 132.9 |
| 6 (CH2) | 44.5 |
| 7 (CH) | 67 |
| 8 (CH2) | 48.9 |
| 9 (C) | 24.2 |
| 10 (CH3) | 17.9 |
| 11 (CH3) | 23.5 |
| 12 (CH) | 132.6 |
| 13 (CH) | 127 |
| 14 (CH) | 122.3 |
| 15 (C) | 140.7 |
| 16 (CH3) | 16.4 |
| 17 (CH2) | 40.2 |
| 18 (CH2) | 25.1 |
| 19 (CH) | 122.8 |
| 20 (C) | 133.9 |
| 21 (CH3) | 17.6 |
| 22 (CH3) | 26.3 |
