Spektraris NMR
Carnosiflogenin C
Common Name: Carnosiflogenin C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H50O3/c1-19(18-31)9-8-10-20(2)21-15-16-28(5)24-13-11-22-23(12-14-25(32)27(22,3)4)30(24,7)26(33)17-29(21,28)6/h9,11,20-21,23-26,31-33H,8,10,12-18H2,1-7H3/b19-9+/t20-,21-,23-,24+,25+,26-,28+,29-,30+/m1/s1
InChIKey: InChIKey=FJWNWRYKEFLJJP-BJMLNTCBSA-N
Formula: C30H50O3
Molecular Weight: 458.717329
Exact Mass: 458.375995
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Chen, J.C., Niu, X.M., Li, Z.R., Qiu, M.H. Planta Med (2005) 71, 983-6
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Cucurbitanes; 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) | 25.8 |
| 2 (CH2) | 30.8 |
| 3 (CH) | 76.3 |
| 4 (C) | 42.3 |
| 5 (C) | 144.2 |
| 6 (CH) | 119.2 |
| 7 (CH2) | 24.6 |
| 8 (CH) | 43.6 |
| 9 (C) | 40.2 |
| 10 (CH) | 36.6 |
| 11 (CH) | 77.8 |
| 12 (CH2) | 41.1 |
| 13 (C) | 47.4 |
| 14 (C) | 49.8 |
| 15 (CH2) | 34.5 |
| 16 (CH2) | 28.4 |
| 17 (CH) | 50.7 |
| 18 (CH3) | 17 |
| 19 (CH3) | 26.7 |
| 20 (CH) | 36.2 |
| 21 (CH3) | 18.8 |
| 22 (CH2) | 36.9 |
| 23 (CH2) | 24.9 |
| 24 (CH) | 125.1 |
| 25 (C) | 136.1 |
| 26 (CH2) | 68.1 |
| 27 (CH3) | 14 |
| 28 (CH3) | 27.3 |
| 29 (CH3) | 26.2 |
| 30 (CH3) | 19.3 |
