Spektraris NMR
Salpichrolide H
Common Name: Salpichrolide H
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C28H36O6/c1-15(21-14-25(2,31)27(4,32)24(30)33-21)16-7-9-18-17(12-16)8-10-20-19(18)13-23-28(34-23)11-5-6-22(29)26(20,28)3/h5-7,9,12,15,19-21,23-24,30-32H,8,10-11,13-14H2,1-4H3/t15-,19-,20-,21?,23-,24-,25-,26-,27-,28-/m0/s1
InChIKey: InChIKey=UPOXIHOCSBWLNQ-JIYQVSPESA-N
Formula: C28H36O6
Molecular Weight: 468.582902
Exact Mass: 468.251189
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Tettamanzi, M.C., Veleiro, A.S., Oberti, J.C., Burton, G. J Nat Prod (1998) 61, 338-42
Species:
Notes: Family : Steroids, Type : Abeo-Ergostanes, Group : Withanolides; 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 (C) | 202.6 |
| 2 (CH) | 128.9 |
| 3 (CH) | 142.5 |
| 4 (CH2) | 33.6 |
| 5 (C) | 64.7 |
| 6 (CH) | 59 |
| 7 (CH2) | 30.4 |
| 8 (CH) | 33.2 |
| 9 (CH) | 36.9 |
| 10 (C) | 48.8 |
| 11 (CH2) | 25.4 |
| 12 (CH2) | 30.6 |
| 13 (C) | 137.8 |
| 14 (C) | 137.2 |
| 15 (CH) | 125.5 |
| 16 (CH) | 126.5 |
| 17 (C) | 141.1 |
| 18 (CH) | 128.4 |
| 19 (CH3) | 14.9 |
| 20 (CH) | 43.6 |
| 21 (CH3) | 17.6 |
| 22 (CH) | 68.2 |
| 23 (CH2) | 39 |
| 24 (C) | 71.3 |
| 25 (C) | 75 |
| 26 (CH) | 99.5 |
| 27 (CH3) | 21.5 |
| 28 (CH3) | 23.9 |
