Spektraris NMR
Spicatocadinanolide A
Common Name: Spicatocadinanolide A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O10/c1-10(21)28-13-8-18(4,29-11(2)22)19(26)7-6-17(3,25)16(24)20(19)14(13)12(9-27-5)15(23)30-20/h13,16,24-26H,6-9H2,1-5H3/t13-,16-,17+,18+,19-,20-/m0/s1
InChIKey: InChIKey=UHAQFLNYQMGHEC-HQPKNUJISA-N
Formula: C20H28O10
Molecular Weight: 428.431108
Exact Mass: 428.168247
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Issa, H.H., Chang, S.M., Yang, Y.L., Chang, F.R., Wu, Y.C. Chem Pharm Bull (2006) 54, 1599-601
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Amorphanes; 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) | 78.2 |
| 2 (CH2) | 30.7 |
| 3 (CH2) | 36.5 |
| 4 (C) | 74.3 |
| 5 (CH) | 75.9 |
| 6 (C) | 93.3 |
| 7 (C) | 160.3 |
| 8 (CH) | 66.5 |
| 9 (CH2) | 35.2 |
| 10 (C) | 86.3 |
| 11 (C) | 129 |
| 12 (C) | 174.2 |
| 13 (CH2) | 64 |
| 14 (CH3) | 20.2 |
| 15 (CH3) | 21.1 |
| 8a (C) | 171.1 |
| 8b (CH3) | 23.2 |
| 10a (C) | 171.5 |
| 10b (CH3) | 21.1 |
| 13a (CH3) | 58.4 |
