Spektraris NMR
Albopilosin J
Common Name: Albopilosin J
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C26H42O10/c1-11-17-12(28)7-15-25(3)6-4-5-24(2,14(25)8-16(29)26(15,21(11)33)22(17)34)10-35-23-20(32)19(31)18(30)13(9-27)36-23/h11-20,22-23,27-32,34H,4-10H2,1-3H3/t11-,12+,13-,14-,15+,16-,17-,18-,19+,20-,22-,23-,24-,25-,26+/m1/s1
InChIKey: InChIKey=JQJBEHOGHZETSG-IWHWUFCXSA-N
Formula: C26H42O10
Molecular Weight: 514.606694
Exact Mass: 514.277798
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Huang, S.X., Zhao, Q.S., Xu, G., Xiao, W.L., Li, R.T., Hou, A.J., Peng, S.L., Ding, L.S., Sun, H.D. J Nat Prod (2005) 68, 1758-62
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 38.3 |
| 2 (CH2) | 18 |
| 3 (CH2) | 35.9 |
| 4 (C) | 38.7 |
| 5 (CH) | 45.9 |
| 6 (CH2) | 29.9 |
| 7 (CH) | 74.9 |
| 8 (C) | 60.7 |
| 9 (CH) | 56.4 |
| 10 (C) | 37.6 |
| 11 (CH2) | 26.5 |
| 12 (CH) | 66.6 |
| 13 (CH) | 51 |
| 14 (CH) | 71.5 |
| 15 (C) | 222.1 |
| 16 (CH) | 43.4 |
| 17 (CH3) | 9.8 |
| 18 (CH2) | 78.6 |
| 19 (CH3) | 18 |
| 20 (CH3) | 17.1 |
| 1' (CH) | 105.5 |
| 2' (CH) | 74.8 |
| 3' (CH) | 78.5 |
| 4' (CH) | 71.5 |
| 5' (CH) | 78.6 |
| 6' (CH2) | 62.7 |
