Spektraris NMR
Latazienone
Common Name: Latazienone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C35H44O9/c1-18(2)32(39)42-28-21(5)17-35(44-23(7)37)26(28)15-19(3)29(43-33(40)24-13-11-10-12-14-24)30(41-22(6)36)27-25(34(27,8)9)16-20(4)31(35)38/h10-16,18,21,25-30H,17H2,1-9H3/b19-15+,20-16+/t21-,25+,26-,27+,28-,29-,30-,35+/m0/s1
InChIKey: InChIKey=CORQBVFVLIREHE-QQJQLWKSSA-N
Formula: C35H44O9
Molecular Weight: 608.719794
Exact Mass: 608.298533
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rondon, M., Morales, A., Amaro-Luis, J.M., Bahsasz, A., Rojasy, J., Buitragoy, D. Nat Prod Res (2005) 19, 597-602
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Lathyranes; 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) | 44.3 |
| 2 (CH) | 38.3 |
| 3 (CH) | 79.8 |
| 4 (CH) | 50.4 |
| 5 (CH) | 123.4 |
| 6 (C) | 138.6 |
| 7 (CH) | 78.5 |
| 8 (CH) | 72.9 |
| 9 (CH) | 33.5 |
| 10 (C) | 25 |
| 11 (CH) | 29.9 |
| 12 (CH) | 143.9 |
| 13 (C) | 133.4 |
| 14 (C) | 194.6 |
| 15 (C) | 94.5 |
| 16 (CH3) | 19.2 |
| 17 (CH3) | 18.1 |
| 18 (CH3) | 25 |
| 19 (CH3) | 16.3 |
| 20 (CH3) | 12.2 |
| 3a (C) | 175.3 |
| 3b (CH) | 34 |
| 3c (CH3) | 14 |
| 3ba (CH3) | 13.9 |
| 7a (C) | 165 |
| 7b (C) | 129.6 |
| 7c (CH) | 129.6 |
| 7d (CH) | 128.3 |
| 7e (CH) | 133.3 |
| 7f (CH) | 128.3 |
| 7g (CH) | 129.6 |
| 8a (C) | 170.1 |
| 8b (CH3) | 21.1 |
| 15a (C) | 169.5 |
| 15b (CH3) | 21.1 |
