Spektraris NMR
Albopilosin B
Common Name: Albopilosin B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H34O6/c1-11-17-13(25)8-15-21(4)7-5-6-20(3,10-23)14(21)9-16(26)22(15,18(17)27)19(11)28-12(2)24/h13-19,23,25-27H,1,5-10H2,2-4H3/t13-,14+,15-,16+,17+,18+,19+,20+,21+,22+/m0/s1
InChIKey: InChIKey=CURUPWUJKYCHHO-XGALNGSSSA-N
Formula: C22H34O6
Molecular Weight: 394.502605
Exact Mass: 394.235539
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) | 40.5 |
| 2 (CH2) | 18.6 |
| 3 (CH2) | 35.8 |
| 4 (C) | 38 |
| 5 (CH) | 46.6 |
| 6 (CH2) | 30.6 |
| 7 (CH) | 75.7 |
| 8 (C) | 54.4 |
| 9 (CH) | 51.8 |
| 10 (C) | 38.5 |
| 11 (CH2) | 26.4 |
| 12 (CH) | 73.9 |
| 13 (CH) | 59.3 |
| 14 (CH) | 72.8 |
| 15 (CH) | 76.2 |
| 16 (C) | 152.3 |
| 17 (CH2) | 109.6 |
| 18 (CH2) | 71.4 |
| 19 (CH3) | 18.2 |
| 20 (CH3) | 17.4 |
| 15a (C) | 171.2 |
| 15b (CH3) | 21 |
