Spektraris NMR
Baenzigeride A
Common Name: Baenzigeride A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H22O6/c1-18-8-14(11-4-6-24-9-11)26-16(21)13(18)3-5-19(2)15(18)7-12-10-25-17(22)20(12,19)23/h3-4,6,9,12,14-15,23H,5,7-8,10H2,1-2H3/t12-,14-,15-,18+,19+,20-/m0/s1
InChIKey: InChIKey=WDTUOLYNVPVKAD-OXPMVUBLSA-N
Formula: C20H22O6
Molecular Weight: 358.385844
Exact Mass: 358.141638
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Tuntiwachwuttikul, P., Boonrasri, N., Bremner, J.B., Taylor, W.C. Phytochemistry (1999) 52, 1335-40
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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) | 33.3 |
| 2 (CH) | 43 |
| 3 (CH2) | 72.7 |
| 4 (C) | 85.6 |
| 5 (C) | 46.7 |
| 6 (CH2) | 30 |
| 7 (CH) | 133.5 |
| 8 (C) | 134 |
| 9 (C) | 34.2 |
| 10 (CH) | 50.8 |
| 11 (CH2) | 43.4 |
| 12 (CH) | 70.9 |
| 13 (C) | 123.7 |
| 14 (CH) | 108.4 |
| 15 (CH) | 143.4 |
| 16 (CH) | 139.4 |
| 17 (C) | 169.7 |
| 18 (C) | 177.4 |
| 19 (CH3) | 21.2 |
| 20 (CH3) | 27.5 |
