Spektraris NMR
Sarcotin B
Common Name: Sarcotin B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H34O4/c1-18(8-5-9-19(2)11-7-13-22-14-15-28-17-22)10-6-12-20(3)16-23-24(26)21(4)25(27)29-23/h5,8-9,12,14-15,17-18,23,26H,6-7,10-11,13,16H2,1-4H3/b8-5-,19-9-,20-12-/t18?,23-/m0/s1
InChIKey: InChIKey=UXFNAATUJSSAHF-NWSWWEOTSA-N
Formula: C25H34O4
Molecular Weight: 398.536003
Exact Mass: 398.24571
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Liu, Y., Bae, B.H., Alam, N., Hong, J., Sim, C.J., Lee, C.O., Im, K.S., Jung, J.H. J Nat Prod (2001) 64, 1301-4
Species:
Notes: Family : Terpenoids, Type : Sesterterpenoids, Group : Acyclics; 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) | 143.9 |
| 2 (CH) | 111.9 |
| 3 (C) | 124.8 |
| 4 (CH) | 140.1 |
| 5 (CH2) | 25.2 |
| 6 (CH2) | 29.5 |
| 7 (CH2) | 40.6 |
| 8 (C) | 138.5 |
| 9 (CH3) | 16.3 |
| 10 (CH) | 121.8 |
| 11 (CH) | 121.8 |
| 12 (CH) | 137.1 |
| 13 (CH) | 32.5 |
| 14 (CH3) | 21.8 |
| 15 (CH2) | 38.8 |
| 16 (CH2) | 26.9 |
| 17 (CH) | 129.5 |
| 18 (C) | 132.1 |
| 19 (CH3) | 24.3 |
| 20 (CH2) | 35.9 |
| 21 (CH) | 78.7 |
| 22 (C) | 182.3 |
| 23 (C) | 90.4 |
| 24 (C) | 189.2 |
| 25 (CH3) | 6 |
