Spektraris NMR
Desfurano-6b-hydroxyazadiradione
Common Name: Desfurano-6b-hydroxyazadiradione
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H32O5/c1-13(25)29-20-18(28)19-21(2,3)17(27)8-10-23(19,5)15-7-9-22(4)12-14(26)11-16(22)24(15,20)6/h8,10-11,15,18-20,28H,7,9,12H2,1-6H3/t15-,18-,19+,20-,22+,23-,24-/m1/s1
InChIKey: InChIKey=HKVOPFDXIGAKHQ-CXCOWLLISA-N
Formula: C24H32O5
Molecular Weight: 400.50879
Exact Mass: 400.224974
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Siddiqui, B.S., Afshan, F., Faizi, S., Naeem-Ul-Hassan Naqvi, S., Tariq, R.M. J Nat Prod (2002) 65, 1216-8
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Apotirucallanes; 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) | 156.2 |
| 2 (CH) | 125.9 |
| 3 (C) | 204.5 |
| 4 (C) | 44.5 |
| 5 (CH) | 46.2 |
| 6 (CH) | 65 |
| 7 (CH) | 78.5 |
| 8 (C) | 43.2 |
| 9 (CH) | 37.9 |
| 10 (C) | 39.5 |
| 11 (CH2) | 16.5 |
| 12 (CH2) | 33 |
| 13 (C) | 45.2 |
| 14 (C) | 193.5 |
| 15 (CH) | 123 |
| 16 (C) | 208 |
| 17 (CH2) | 57 |
| 18 (CH3) | 28.5 |
| 19 (CH3) | 18.3 |
| 28 (CH3) | 27 |
| 29 (CH3) | 21.5 |
| 30 (CH3) | 25.9 |
| 7a (C) | 169.5 |
| 7b (CH3) | 21.6 |
