Spektraris NMR
(4R,5R,7S,8S,9S,10S,11S)-7,8,9-Trihydroxyjiquilp-3(12)-ene
Common Name: (4R,5R,7S,8S,9S,10S,11S)-7,8,9-Trihydroxyjiquilp-3(12)-ene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O3/c1-7-5-8-6-9-10(7)15(8,4)13(18)11(16)12(17)14(9,2)3/h8-13,16-18H,1,5-6H2,2-4H3/t8-,9+,10-,11-,12-,13-,15+/m1/s1
InChIKey: InChIKey=DAASHTBRGSTLDB-BMOVTVBKSA-N
Formula: C15H24O3
Molecular Weight: 252.349831
Exact Mass: 252.172545
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Roman, L.U., Cerda-Garcia-Rojas, C.M., Guzman, R., Armenta, C., Hernandez, J.D., Joseph-Nathan, P. J Nat Prod (2002) 65, 1540-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Jiquilpanes; 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) | 32.7 |
| 2 (CH2) | 36.2 |
| 3 (C) | 155.4 |
| 4 (CH) | 54.1 |
| 5 (CH) | 54.4 |
| 6 (C) | 38.2 |
| 7 (CH) | 73.2 |
| 8 (CH) | 71.8 |
| 9 (CH) | 79.1 |
| 10 (C) | 50.4 |
| 11 (CH) | 43.4 |
| 12 (CH2) | 102.7 |
| 13 (CH3) | 27.4 |
| 14 (CH3) | 22.1 |
| 15 (CH3) | 25 |
