Spektraris NMR
Fomitoside F
Common Name: Fomitoside F
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C37H58O8/c1-21(2)10-9-11-23(32(42)45-33-31(41)30(40)27(39)20-43-33)24-14-18-37(8)26-12-13-28-34(4,5)29(44-22(3)38)16-17-35(28,6)25(26)15-19-36(24,37)7/h10,23-24,27-31,33,39-41H,9,11-20H2,1-8H3/t23-,24-,27-,28+,29-,30+,31-,33+,35-,36-,37+/m1/s1
InChIKey: InChIKey=NLXRBHRYKXMKNJ-UHWFYCGOSA-N
Formula: C37H58O8
Molecular Weight: 630.853031
Exact Mass: 630.413169
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Yoshikawa, K., Inoue, M., Matsumoto, Y., Sakakibara, C., Miyataka, H., Matsumoto, H., Arihara, S. J Nat Prod (2005) 68, 69-73
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Lanostanes; 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) | 31.4 |
| 2 (CH2) | 23.9 |
| 3 (CH) | 78 |
| 4 (C) | 37.3 |
| 5 (CH) | 46 |
| 6 (CH2) | 18.6 |
| 7 (CH2) | 26.7 |
| 8 (C) | 134.2 |
| 9 (C) | 135.2 |
| 10 (C) | 37.5 |
| 11 (CH2) | 21.8 |
| 12 (CH2) | 29.3 |
| 13 (C) | 45.2 |
| 14 (C) | 50.5 |
| 15 (CH2) | 31.2 |
| 16 (CH2) | 27.6 |
| 17 (CH) | 47.8 |
| 18 (CH3) | 16.8 |
| 19 (CH3) | 19.4 |
| 20 (CH) | 48.6 |
| 21 (C) | 175.9 |
| 22 (CH2) | 33.8 |
| 23 (CH2) | 26.5 |
| 24 (CH) | 124.8 |
| 25 (C) | 132 |
| 26 (CH3) | 26.1 |
| 27 (CH3) | 18.2 |
| 28 (CH3) | 28.1 |
| 29 (CH3) | 22.2 |
| 30 (CH3) | 24.7 |
| 1' (CH) | 96.5 |
| 2' (CH) | 73.9 |
| 3' (CH) | 79 |
| 4' (CH) | 71.1 |
| 5' (CH2) | 68.3 |
| 3a (C) | 170 |
| 3b (CH3) | 21.1 |
