Spektraris NMR
Hyatelone B
Common Name: Hyatelone B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C27H42O7/c1-14(28)33-18-12-16-24(4)10-7-9-23(2,3)15(24)8-11-25(16,5)17-13-19-27(32,20(29)21(30)34-19)22(31)26(17,18)6/h15-21,29-30,32H,7-13H2,1-6H3/t15-,16+,17-,18-,19-,20-,21-,24-,25+,26+,27-/m0/s1
InChIKey: InChIKey=LHXGNBASUYLJJT-MVAOLVNHSA-N
Formula: C27H42O7
Molecular Weight: 478.619215
Exact Mass: 478.293054
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Hernandez-Guerrero, C.J., Zubia, E., Ortega, M.J., Carballo, J.L. Tetrahedron (2006) 62, 5392-400
Species:
Notes: Family : Terpenoids, Type : Sesterterpenoids, Group : Scalaranes; 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 (CH2) | 39.6 |
| 2 (CH2) | 18.4 |
| 3 (CH2) | 41.9 |
| 4 (C) | 33.3 |
| 5 (CH) | 56.7 |
| 6 (CH2) | 18 |
| 7 (CH2) | 41 |
| 8 (C) | 37.9 |
| 9 (CH) | 52.4 |
| 10 (C) | 36.9 |
| 11 (CH2) | 21.6 |
| 12 (CH) | 74.6 |
| 13 (C) | 52.1 |
| 14 (CH) | 44.8 |
| 15 (CH2) | 25.6 |
| 16 (CH) | 84.3 |
| 17 (C) | 83.6 |
| 18 (C) | 215.3 |
| 19 (CH) | 102.6 |
| 20 (CH) | 82.6 |
| 21 (CH3) | 33.2 |
| 22 (CH3) | 21.3 |
| 23 (CH3) | 16 |
| 24 (CH3) | 17.8 |
| 25 (CH3) | 19 |
| 12a (C) | 169.9 |
| 12b (CH3) | 21.2 |
