Spektraris NMR
Cespihypotin T
Common Name: Cespihypotin T
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H28O4/c1-12-5-6-14-7-8-16(21)19(23,18(14,3)4)17(22)11-13(2)10-15(20)9-12/h10,14,17,22-23H,1,5-9,11H2,2-4H3/b13-10+/t14-,17+,19-/m1/s1
InChIKey: InChIKey=BGLFCTUQGKZUGQ-WFHDAKLFSA-N
Formula: C19H28O4
Molecular Weight: 320.423943
Exact Mass: 320.198759
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Shen, Y.C., Lo, K.L., Kuo, Y.H., Kuo, Y.C., Chen, C.H., Khalil, A.T. J Nat Prod (2008) 71, 1993-7
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Verticillanes; 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) | 43.3 |
| 2 (CH2) | 28.3 |
| 3 (CH2) | 32.1 |
| 4 (C) | 145.8 |
| 5 (CH2) | 42.5 |
| 6 (C) | 207 |
| 7 (CH) | 121.6 |
| 8 (C) | 151.5 |
| 9 (CH2) | 46 |
| 10 (CH) | 68.9 |
| 11 (C) | 81.5 |
| 12 (C) | 213.2 |
| 13 (CH2) | 18.2 |
| 14 (CH2) | 31.2 |
| 15 (C) | 49.5 |
| 16 (CH3) | 26 |
| 17 (CH3) | 22.7 |
| 19 (CH3) | 20.9 |
| 20 (CH2) | 113.9 |
