Spektraris NMR
Sipholenol G
Common Name: Sipholenol G
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H52O5/c1-25(2)18-11-15-28(6,32)19(18)17-24-30(8,35-24)20(25)9-10-21-27(5)14-12-22(31)26(3,4)34-23(27)13-16-29(21,7)33/h18-24,31-33H,9-17H2,1-8H3/t18-,19-,20-,21-,22-,23?,24+,27-,28-,29+,30-/m1/s1
InChIKey: InChIKey=PJGLAGRJBNYJJV-MNAQFPAWSA-N
Formula: C30H52O5
Molecular Weight: 492.732021
Exact Mass: 492.381475
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Kashman, Y., Yosief, T., Carmeli, S. J Nat Prod (2001) 64, 175-80
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Sipholanes; 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) | 42.6 |
| 2 (CH2) | 34 |
| 3 (CH2) | 25.2 |
| 4 (CH) | 76.6 |
| 5 (C) | 77.9 |
| 7 (CH) | 76.6 |
| 8 (CH2) | 26.6 |
| 9 (CH2) | 39 |
| 10 (C) | 71.8 |
| 11 (CH) | 55.8 |
| 12 (CH2) | 27.6 |
| 13 (CH2) | 33.1 |
| 14 (CH) | 56 |
| 15 (C) | 60.8 |
| 16 (CH) | 61.9 |
| 17 (CH2) | 30.4 |
| 18 (CH) | 46.9 |
| 19 (C) | 81.3 |
| 20 (CH2) | 37 |
| 21 (CH2) | 24 |
| 22 (CH) | 52.9 |
| 23 (C) | 37.1 |
| 24 (CH3) | 12.8 |
| 25 (CH3) | 21.2 |
| 26 (CH3) | 28.9 |
| 27 (CH3) | 30 |
| 28 (CH3) | 30.4 |
| 29 (CH3) | 25.3 |
| 30 (CH3) | 28.1 |
| 31 (CH3) | 33.4 |
