Spektraris NMR
Excoagallochaol A
Common Name: Excoagallochaol A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O2/c1-14(2)6-5-9-18(3)12-16-15(18)7-10-19(4)13-20(16,22)11-8-17(19)21/h6,15-17,21-22H,5,7-13H2,1-4H3/t15-,16+,17-,18-,19-,20+/m1/s1
InChIKey: InChIKey=YDTOFWJXBWKIKO-BGSOWLKRSA-N
Formula: C20H34O2
Molecular Weight: 306.483513
Exact Mass: 306.25588
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wang, J.D., Zhang, W., Li, Z.Y., Xiang, W.S., Guo, Y.W., Krohn, K. Phytochemistry (2007) 68, 2426-31
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 (C) | 72.5 |
| 2 (CH) | 41.8 |
| 3 (CH2) | 33.2 |
| 4 (C) | 37.1 |
| 5 (CH) | 47.3 |
| 6 (CH2) | 22.2 |
| 7 (CH2) | 36.1 |
| 8 (C) | 37.6 |
| 9 (CH) | 74 |
| 10 (CH2) | 27.1 |
| 11 (CH2) | 35.8 |
| 12 (CH2) | 38.4 |
| 13 (CH3) | 21.4 |
| 14 (CH2) | 41.1 |
| 15 (CH3) | 30.1 |
| 16 (CH2) | 23.8 |
| 17 (CH) | 124.8 |
| 18 (C) | 130.9 |
| 19 (CH3) | 17.8 |
| 20 (CH3) | 25.8 |
