Spektraris NMR
Kuhistanicaol G
Common Name: Kuhistanicaol G
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H30O5/c1-14(2)22(26)12-10-20(3)9-11-21(4,25)13-17(18(20)22)27-19(24)15-5-7-16(23)8-6-15/h5-9,11,14,17-18,23,25-26H,10,12-13H2,1-4H3/t17-,18+,20-,21-,22+/m0/s1
InChIKey: InChIKey=MQNDIFGHQSDIOB-XRYRHKQGSA-N
Formula: C22H30O5
Molecular Weight: 374.471437
Exact Mass: 374.209324
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Chen, B., Teranishi, R., Kawazoe, K., Takaishi, Y., Honda, G., Itoh, M., Takeda, Y., Kodzhimatov, O.K. Phytochemistry (2000) 54, 717-22
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Daucanes; 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 (C) | 46.8 |
| 2 (CH2) | 42.3 |
| 3 (CH2) | 32 |
| 4 (C) | 87 |
| 5 (CH) | 52.7 |
| 6 (CH) | 73.1 |
| 7 (CH2) | 45.2 |
| 8 (C) | 71.6 |
| 9 (CH) | 133.4 |
| 10 (CH) | 142.2 |
| 11 (CH) | 37.4 |
| 12 (CH3) | 17.8 |
| 13 (CH3) | 18.9 |
| 14 (CH3) | 34.2 |
| 15 (CH3) | 21.1 |
| 1' (C) | 123.4 |
| 2' (CH) | 133 |
| 3' (CH) | 116 |
| 4' (C) | 163.3 |
| 5' (CH) | 116 |
| 6' (CH) | 133 |
| 7' (C) | 168.3 |
