Spektraris NMR
Vibsanin M
Common Name: Vibsanin M
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H34O7/c1-15(2)11-23(30)32-10-8-20-19(12-17(5)27)24(31)18(14-26)13-22(29)25(20,6)9-7-21(28)16(3)4/h8,10-13,20-22,26,28-29H,3,7,9,14H2,1-2,4-6H3/b10-8+,19-12-/t20-,21?,22-,25+/m0/s1
InChIKey: InChIKey=IPRGISIXZIYESP-GQLNULAHSA-N
Formula: C25H34O7
Molecular Weight: 446.534218
Exact Mass: 446.230453
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Shen, Y.C., Lin, C.L., Chien, S.C., Khalil, A.T., Ko, C.L., Wang, C.H. J Nat Prod (2004) 67, 74-7
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Vibsanes; 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) | 78.4 |
| 2 (CH) | 143.9 |
| 3 (C) | 137.6 |
| 4 (C) | 195.8 |
| 5 (C) | 149 |
| 6 (CH) | 134 |
| 7 (C) | 200.1 |
| 8 (CH) | 138.1 |
| 9 (CH) | 107.9 |
| 10 (CH) | 48 |
| 11 (C) | 38.9 |
| 12 (CH2) | 33 |
| 13 (CH2) | 29.7 |
| 14 (CH) | 74.3 |
| 15 (C) | 145.2 |
| 16 (CH2) | 111.1 |
| 17 (CH3) | 18.8 |
| 18 (CH2) | 62.8 |
| 19 (CH3) | 30 |
| 20 (CH3) | 17.1 |
| 8a (C) | 162.9 |
| 8b (CH) | 114.3 |
| 8c (C) | 161 |
| 8d (CH3) | 27.7 |
| 8ca (CH3) | 20.6 |
