Spektraris NMR
21-Hydroxy-petrosaspongiolide P
Common Name: 21-Hydroxy-petrosaspongiolide P
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H38O6/c1-23(13-26)8-4-9-25(3)18(23)7-10-24(2)16-12-17(15-11-20(27)31-22(15)29)30-21(28)14(16)5-6-19(24)25/h11,14,16-19,21-22,26,28-29H,4-10,12-13H2,1-3H3/t14-,16+,17+,18-,19-,21?,22?,23+,24-,25-/m0/s1
InChIKey: InChIKey=ILNQYSBBUXQHRX-XWGFQBHESA-N
Formula: C25H38O6
Molecular Weight: 434.566576
Exact Mass: 434.266839
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - De Marino, S., Iorizzi, M., Zollo, F., Debitus, C., Menou, J.L., Ospina, L.F., Alcaraz, M.J., Paya, M. J Nat Prod (2000) 63, 322-6
Species:
Notes: Family : Terpenoids, Type : Sesterterpenoids, Group : Cheilanthanes; 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) | 41.2 |
| 2 (CH2) | 19.2 |
| 3 (CH2) | 36.7 |
| 4 (C) | 38.5 |
| 5 (CH) | 58.5 |
| 6 (CH2) | 19.6 |
| 7 (CH2) | 39.7 |
| 8 (C) | 37.6 |
| 9 (CH) | 61.1 |
| 10 (C) | 40.2 |
| 11 (CH2) | 20.7 |
| 12 (CH2) | 29.5 |
| 13 (CH) | 42.4 |
| 14 (CH) | 53.4 |
| 15 (CH2) | 30.7 |
| 16 (CH) | 73 |
| 17 (C) | 164.7 |
| 18 (CH) | 118.2 |
| 19 (C) | 173.4 |
| 20 (CH3) | 27.6 |
| 21 (CH2) | 65.1 |
| 22 (CH3) | 17.3 |
| 23 (CH3) | 15.3 |
| 24 (CH) | 101.8 |
| 25 (CH) | 95.5 |
