Spektraris NMR
Tricholomalide A
Common Name: Tricholomalide A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O5/c1-10(2)12-6-13(21)16-17-20(23,11(3)9-24-17)19(5)8-15(22)25-14(19)7-18(12,16)4/h10,12,14,16-17,23H,3,6-9H2,1-2,4-5H3/t12-,14+,16-,17-,18-,19+,20+/m0/s1
InChIKey: InChIKey=FNWXCFNQVRNNMR-AAQVCALCSA-N
Formula: C20H28O5
Molecular Weight: 348.434084
Exact Mass: 348.193674
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Tsukamoto, S., Macabalang, A.D., Nakatani, K., Obara, Y., Nakahata, N., Ohta, T. J Nat Prod (2003) 66, 1578-81
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 (CH) | 78.7 |
| 2 (C) | 80.4 |
| 3 (C) | 154.4 |
| 4 (CH2) | 71.9 |
| 5 (C) | 46.4 |
| 6 (CH2) | 35.1 |
| 7 (C) | 175.9 |
| 8 (CH) | 84.4 |
| 9 (CH2) | 38.5 |
| 10 (C) | 42.7 |
| 11 (CH) | 61.6 |
| 12 (C) | 216 |
| 13 (CH2) | 40.2 |
| 14 (CH) | 44.2 |
| 15 (CH) | 29 |
| 16 (CH3) | 22.8 |
| 17 (CH3) | 23.3 |
| 18 (CH3) | 24.4 |
| 19 (CH3) | 25.4 |
| 20 (CH2) | 109.4 |
