Spektraris NMR
Jinfushanosides A
Common Name: Jinfushanosides A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C36H60O9/c1-20(8-7-9-21(17-37)18-38)22-14-15-34(4)26-12-10-23-24(36(26,6)27(40)16-35(22,34)5)11-13-28(33(23,2)3)45-32-31(43)30(42)29(41)25(19-39)44-32/h9-10,20,22,24-32,37-43H,7-8,11-19H2,1-6H3/t20-,22-,24-,25-,26+,27-,28+,29-,30+,31-,32+,34+,35-,36+/m1/s1
InChIKey: InChIKey=SIHQLSDQWIFIMC-GJUJOHLBSA-N
Formula: C36H60O9
Molecular Weight: 636.857582
Exact Mass: 636.423734
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Chen, J.C., Niu, X.M., Li, Z.R., Qiu, M.H. Planta Med (2005) 71, 983-6
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Cucurbitanes; 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) | 26.8 |
| 2 (CH2) | 29.5 |
| 3 (CH) | 87.9 |
| 4 (C) | 42.4 |
| 5 (C) | 144.2 |
| 6 (CH) | 118.4 |
| 7 (CH2) | 24.6 |
| 8 (CH) | 43.5 |
| 9 (C) | 40.1 |
| 10 (CH) | 36.1 |
| 11 (CH) | 77.8 |
| 12 (CH2) | 41 |
| 13 (C) | 47.3 |
| 14 (C) | 49.7 |
| 15 (CH2) | 34.4 |
| 16 (CH2) | 28.3 |
| 17 (CH) | 50.6 |
| 18 (CH3) | 16.9 |
| 19 (CH3) | 26.8 |
| 20 (CH) | 36.8 |
| 21 (CH3) | 18.7 |
| 22 (CH2) | 36.9 |
| 23 (CH2) | 24.5 |
| 24 (CH) | 127.6 |
| 25 (C) | 140.7 |
| 26 (CH2) | 65.4 |
| 27 (CH2) | 58.5 |
| 28 (CH3) | 27.6 |
| 29 (CH3) | 26.8 |
| 30 (CH3) | 19.3 |
| 1' (CH) | 107.4 |
| 2' (CH) | 75.5 |
| 3' (CH) | 78.7 |
| 4' (CH) | 71.7 |
| 5' (CH) | 77.8 |
| 6' (CH2) | 63 |
