Spektraris NMR
Amotsangins F
Common Name: Amotsangins F
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C35H38O10/c1-20-28(33(4)14-12-26(37)45-32(2,3)24(33)17-27(38)40-6)29(42-19-36)30(43-31(39)21-10-8-7-9-11-21)34(5)23(22-13-15-41-18-22)16-25-35(20,34)44-25/h7-15,18-19,23-25,28-30H,1,16-17H2,2-6H3/t23-,24-,25+,28+,29+,30-,33-,34+,35+/m0/s1
InChIKey: InChIKey=MBJRGZBGRXEENH-XHJYCJBQSA-N
Formula: C35H38O10
Molecular Weight: 618.671554
Exact Mass: 618.246497
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Chen, H.D., Yang, S.P., Liao, S.G., Zhang, B., Wu, Y., Yue, J.M. J Nat Prod (2008) 71, 93-7
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Limonoids; 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) | 148.2 |
| 2 (CH) | 122.6 |
| 3 (C) | 166.9 |
| 4 (C) | 83.5 |
| 5 (CH) | 50.6 |
| 6 (CH2) | 35 |
| 7 (C) | 173.5 |
| 8 (C) | 136.6 |
| 9 (CH) | 53.3 |
| 10 (C) | 46.2 |
| 11 (CH) | 71.1 |
| 12 (CH) | 74.7 |
| 13 (C) | 45.5 |
| 14 (C) | 71.1 |
| 15 (CH) | 59.7 |
| 16 (CH2) | 33.5 |
| 17 (CH) | 37.9 |
| 18 (CH3) | 13.7 |
| 19 (CH3) | 22.4 |
| 20 (C) | 122.6 |
| 21 (CH) | 140.4 |
| 22 (CH) | 111 |
| 23 (CH) | 142.3 |
| 28 (CH3) | 30.2 |
| 29 (CH3) | 22.9 |
| 30 (CH2) | 121.2 |
| 7a (CH3) | 52.3 |
| 11a (CH) | 160.1 |
| 12a (C) | 165.5 |
| 12b (C) | 129.5 |
| 12c (CH) | 129.6 |
| 12d (CH) | 128.2 |
| 12e (CH) | 132.9 |
| 12f (CH) | 128.2 |
| 12g (CH) | 129.6 |
