Spektraris NMR
Artemyriantholide C
Common Name: Artemyriantholide C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H38O6/c1-14-6-11-30-20(14)23-19(8-10-27(30,5)36-30)28(25(32)35-23)12-17-13-29(28)21(15(17)2)22-18(7-9-26(29,4)33)16(3)24(31)34-22/h6,16-20,22-23,33H,7-13H2,1-5H3/t16-,17-,18+,19-,20-,22-,23+,26-,27+,28?,29+,30-/m1/s1
InChIKey: InChIKey=OZYQGTHZYGCMID-HXBYHMOYSA-N
Formula: C30H38O6
Molecular Weight: 494.620255
Exact Mass: 494.266839
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wong, H.F., Brown, G.D. J Nat Prod (2002) 65, 481-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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) | 72 |
| 2 (CH2) | 47.1 |
| 3 (CH) | 44.9 |
| 4 (C) | 152.7 |
| 5 (C) | 134.9 |
| 6 (CH) | 79.8 |
| 7 (CH) | 41.8 |
| 8 (CH2) | 21.9 |
| 9 (CH2) | 39 |
| 10 (C) | 72.3 |
| 11 (CH) | 42.7 |
| 12 (C) | 179.9 |
| 13 (CH3) | 9.5 |
| 14 (CH3) | 30 |
| 15 (CH3) | 13.5 |
| 1' (C) | 74.6 |
| 2' (CH2) | 39.3 |
| 3' (CH) | 124.9 |
| 4' (C) | 141.4 |
| 5' (CH) | 53.1 |
| 6' (CH) | 80.1 |
| 7' (CH) | 53.6 |
| 8' (CH2) | 21.7 |
| 9' (CH2) | 33.3 |
| 10' (C) | 62.5 |
| 11' (C) | 55.7 |
| 12' (C) | 181.5 |
| 13' (CH2) | 35.4 |
| 14' (CH3) | 22.6 |
| 15' (CH3) | 18.6 |
