Spektraris NMR
Wuweizidilactone D
Common Name: Wuweizidilactone D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C29H40O8/c1-14-10-17(34-24(14)32)23-15(2)16-11-20(30)26(5)19-7-6-18-25(3,4)35-21-12-22(31)36-28(18,21)13-27(19,33)8-9-29(16,26)37-23/h10,15-21,23,30,33H,6-9,11-13H2,1-5H3/t15-,16-,17-,18-,19-,20-,21+,23-,26-,27-,28+,29-/m0/s1
InChIKey: InChIKey=PUJCPBFCIUPCFY-JQFIDVAJSA-N
Formula: C29H40O8
Molecular Weight: 516.624211
Exact Mass: 516.272318
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Huang, S.X., Yang, L.B., Xiao, W.L., Lei, C., Liu, J.P., Lu, Y., Weng, Z.Y., Li, L.M., Li, R.T., Yu, J.L., Zheng, Q.T., Sun, H.D. Chem Eur J (2007) 13, 4816-22
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) | 82.3 |
| 2 (CH2) | 37 |
| 3 (C) | 175.8 |
| 4 (C) | 85.1 |
| 5 (CH) | 58.8 |
| 6 (CH2) | 29 |
| 7 (CH2) | 25.4 |
| 8 (CH) | 57.6 |
| 9 (C) | 70.2 |
| 10 (C) | 99.7 |
| 11 (CH2) | 38.2 |
| 12 (CH2) | 35.8 |
| 13 (C) | 93.4 |
| 14 (C) | 55.2 |
| 15 (CH) | 78.8 |
| 16 (CH2) | 33 |
| 17 (CH) | 53.6 |
| 18 (CH3) | 24 |
| 19 (CH2) | 47.7 |
| 20 (CH) | 36 |
| 21 (CH3) | 12.5 |
| 22 (CH) | 87.9 |
| 23 (CH) | 81.8 |
| 24 (CH) | 147.2 |
| 25 (C) | 130.5 |
| 26 (C) | 174.5 |
| 27 (CH3) | 10.9 |
| 28 (CH3) | 30 |
| 29 (CH3) | 23.6 |
