Spektraris NMR
Artemyriantholide D
Common Name: Artemyriantholide D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H36O6/c1-15-6-11-30-19(15)21-18(8-10-27(30,5)36-30)29(24(32)35-21)14-28-13-12-25(29,3)22(28)20-17(7-9-26(28,4)33)16(2)23(31)34-20/h6,12-13,17-22,33H,2,7-11,14H2,1,3-5H3/t17-,18+,19?,20-,21-,22-,25+,26+,27-,28-,29+,30+/m0/s1
InChIKey: InChIKey=ZIEXIIVSXSCSRL-OZLKXCGHSA-N
Formula: C30H36O6
Molecular Weight: 492.604374
Exact Mass: 492.251189
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) | 62.8 |
| 2 (CH) | 135.8 |
| 3 (CH) | 138.3 |
| 4 (C) | 61.2 |
| 5 (CH) | 66.6 |
| 6 (CH) | 79.4 |
| 7 (CH) | 43.2 |
| 8 (CH2) | 23.7 |
| 9 (CH2) | 34.7 |
| 10 (C) | 72.7 |
| 11 (C) | 141 |
| 12 (C) | 170.6 |
| 13 (CH2) | 118.6 |
| 14 (CH3) | 29.8 |
| 15 (CH3) | 16.5 |
| 1' (C) | 72.1 |
| 2' (CH2) | 39.3 |
| 3' (CH) | 125 |
| 4' (C) | 141 |
| 5' (CH) | 53.4 |
| 6' (CH) | 81.2 |
| 7' (CH) | 57.5 |
| 8' (CH2) | 21.5 |
| 9' (CH2) | 34.4 |
| 10' (C) | 62.1 |
| 11' (C) | 56.5 |
| 12' (C) | 181.2 |
| 13' (CH2) | 41.4 |
| 14' (CH3) | 22.6 |
| 15' (CH3) | 18.6 |
