Spektraris NMR
Rehmapicroside
Common Name: Rehmapicroside
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H26O7/c1-8-9(6-17)16(2,3)5-4-10(8)22-15-14(21)13(20)12(19)11(7-18)23-15/h6,10-15,18-21H,4-5,7H2,1-3H3/t10-,11+,12+,13-,14+,15+/m0/s1
InChIKey: InChIKey=PTAMKCPERQUKLI-MZHQWRCYSA-N
Formula: C16H26O7
Molecular Weight: 330.374068
Exact Mass: 330.167853
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Yoshikawa, M., Fukuda, Y., Taniyama, T., Cha, B.C., Kitagawa, I. Chem Pharm Bull (1986) 34, 2294-7
Species:
Notes: Family : Terpenoids, Type : Monoterpenoids, Group : Cyclocitrals; 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) | 73.1 |
| 2 (CH2) | 24 |
| 3 (CH2) | 33.7 |
| 4 (C) | 32.7 |
| 5 (C) | 140.5 |
| 6 (C) | 129.8 |
| 7 (CH3) | 27.9 |
| 8 (CH3) | 26.9 |
| 9 (CH) | 171.7 |
| 10 (CH3) | 17.9 |
| 1' (CH) | 104 |
| 2' (CH) | 75 |
| 3' (CH) | 78.1 |
| 4' (CH) | 71.7 |
| 5' (CH) | 78 |
| 6' (CH2) | 62.8 |
