Spektraris NMR
2b-Hydroxysalvigenolide
Common Name: 2b-Hydroxysalvigenolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H22O8/c1-10-15-5-13(24)6-16-21(26)28-9-22(15,16)17(29-11(2)23)7-14-18(10)19(30-20(14)25)12-3-4-27-8-12/h3-4,6,8,13-15,17,19,24H,5,7,9H2,1-2H3/t13-,14-,15+,17+,19-,22+/m0/s1
InChIKey: InChIKey=DUJNCWIGAAEQEN-SGPWCLKLSA-N
Formula: C22H22O8
Molecular Weight: 414.406126
Exact Mass: 414.131468
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Esquivel, B., Tello, R., Sanchez, A.A. J Nat Prod (2005) 68, 787-90
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Miscellanea; 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 (CH2) | 32.1 |
| 2 (CH) | 61.9 |
| 3 (CH) | 137.1 |
| 4 (C) | 132.3 |
| 5 (C) | 47.8 |
| 6 (CH) | 70.7 |
| 7 (CH2) | 30 |
| 8 (CH) | 39.2 |
| 9 (C) | 136 |
| 10 (CH) | 31.1 |
| 11 (C) | 135 |
| 12 (CH) | 75 |
| 13 (C) | 123.9 |
| 14 (CH) | 108.1 |
| 15 (CH) | 144.9 |
| 16 (CH) | 140.7 |
| 17 (C) | 176.4 |
| 18 (C) | 168.2 |
| 19 (CH2) | 68.6 |
| 20 (CH3) | 15.9 |
| 6a (C) | 168.8 |
| 6b (CH3) | 20.9 |
