Spektraris NMR
Landifodilactone C
Common Name: Landifodilactone C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C29H34O9/c1-12-18-20-19(13(2)24(33)34-20)37-29-21(18)26(5,22(12)31)8-9-27(38-29)11-28-15(7-6-14(27)23(29)32)25(3,4)35-16(28)10-17(30)36-28/h6,12-13,15-16,18-21H,7-11H2,1-5H3/t12-,13-,15-,16+,18+,19+,20+,21-,26-,27-,28+,29-/m1/s1
InChIKey: InChIKey=WKRDQUNBIWYNSG-SPYPFQIRSA-N
Formula: C29H34O9
Molecular Weight: 526.575971
Exact Mass: 526.220283
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Li, R., Shen, Y., Xiang, W., Sun, H. Eur J Org Chem (2004) 0, 807-11
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Schiartanes; 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) | 80.6 |
| 2 (CH2) | 35.7 |
| 3 (C) | 175.5 |
| 4 (C) | 83.5 |
| 5 (CH) | 57.8 |
| 6 (CH2) | 23.8 |
| 7 (CH) | 135.5 |
| 8 (C) | 138.2 |
| 9 (C) | 82.2 |
| 10 (C) | 95.1 |
| 11 (CH2) | 39.4 |
| 12 (CH2) | 31.5 |
| 13 (C) | 50.7 |
| 14 (C) | 198.7 |
| 15 (C) | 99.2 |
| 16 (CH) | 45.8 |
| 17 (C) | 220.5 |
| 18 (CH3) | 26.5 |
| 19 (CH2) | 42.3 |
| 20 (CH) | 45 |
| 21 (CH3) | 15 |
| 22 (CH) | 40.3 |
| 23 (CH) | 75.4 |
| 24 (CH) | 68.6 |
| 25 (CH) | 42.5 |
| 26 (C) | 178.3 |
| 27 (CH3) | 8.6 |
| 28 (CH3) | 20.6 |
| 29 (CH3) | 27.7 |
