Spektraris NMR
Cespihypotin L
Common Name: Cespihypotin L
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H32O4/c1-6-26-21(25)18-10-9-16-8-7-14(2)11-17(23)12-15(3)13-19(24)20(18)22(16,4)5/h12,16-17,23H,2,6-11,13H2,1,3-5H3/b15-12+/t16-,17+/m1/s1
InChIKey: InChIKey=GZEDVIPVFYXKDH-ODQHEUEKSA-N
Formula: C22H32O4
Molecular Weight: 360.487914
Exact Mass: 360.23006
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Shen, Y.-C., Wu, Y.-R., Lin, J.-J., Lo, K.-L., Kuo, Y.-C., Khalil, A.T. Tetrahedron (2007) 63, 10914-20
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) | 42.3 |
| 2 (CH2) | 24.4 |
| 3 (CH2) | 33.8 |
| 4 (C) | 146.7 |
| 5 (CH2) | 44.1 |
| 6 (CH) | 69.7 |
| 7 (CH) | 136.9 |
| 8 (C) | 130.9 |
| 9 (CH2) | 54.9 |
| 10 (C) | 207.4 |
| 11 (C) | 160.7 |
| 12 (C) | 124.9 |
| 13 (CH2) | 21.6 |
| 14 (CH2) | 32.9 |
| 15 (C) | 38.9 |
| 16 (CH3) | 25.4 |
| 17 (CH3) | 33.5 |
| 18 (C) | 166.9 |
| 19 (CH3) | 18.5 |
| 20 (CH2) | 114.7 |
| 18a (CH2) | 61.2 |
| 18b (CH3) | 14.1 |
