Spektraris NMR
Floralginsenoside F
Common Name: Floralginsenoside F
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C42H72O15/c1-37(2,57-52)13-9-14-42(8,56-36-34(51)32(49)30(47)24(20-44)54-36)21-10-16-41(7)28(21)22(45)18-26-39(5)15-12-27(38(3,4)25(39)11-17-40(26,41)6)55-35-33(50)31(48)29(46)23(19-43)53-35/h9,13,21-36,43-52H,10-12,14-20H2,1-8H3/b13-9+/t21-,22+,23+,24+,25-,26+,27-,28-,29+,30+,31-,32-,33+,34+,35-,36-,39-,40+,41+,42-/m0/s1
InChIKey: InChIKey=DDOPAXLQAFAFAZ-YZSKAGILSA-N
Formula: C42H72O15
Molecular Weight: 817.013716
Exact Mass: 816.487122
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Yoshikawa, M., Sugimoto, S., Nakamura, S., Matsuda, H. Chem Pharm Bull (2007) 55, 571-6
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Dammaranes; 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) | 39.3 |
| 2 (CH2) | 26.8 |
| 3 (CH) | 88.9 |
| 4 (C) | 39.8 |
| 5 (CH) | 56.5 |
| 6 (CH2) | 18.5 |
| 7 (CH2) | 35.2 |
| 8 (C) | 40.2 |
| 9 (CH) | 50.2 |
| 10 (C) | 37.1 |
| 11 (CH2) | 31.1 |
| 12 (CH) | 70.5 |
| 13 (CH) | 49.7 |
| 14 (C) | 51.6 |
| 15 (CH2) | 30.7 |
| 16 (CH2) | 26.5 |
| 17 (CH) | 52.3 |
| 18 (CH3) | 17.2 |
| 19 (CH3) | 16.3 |
| 20 (C) | 83.2 |
| 21 (CH3) | 23.3 |
| 22 (CH2) | 39.7 |
| 23 (CH) | 126.6 |
| 24 (CH) | 138.1 |
| 25 (C) | 81.3 |
| 26 (CH3) | 25.2 |
| 27 (CH3) | 25.4 |
| 28 (CH3) | 28.2 |
| 29 (CH3) | 16.8 |
| 30 (CH3) | 16 |
| 1' (CH) | 106.9 |
| 2' (CH) | 75.8 |
| 3' (CH) | 78.8 |
| 4' (CH) | 72 |
| 5' (CH) | 78.3 |
| 6' (CH2) | 63.1 |
| 1'' (CH) | 98.3 |
| 2'' (CH) | 75.3 |
| 3'' (CH) | 78.9 |
| 4'' (CH) | 71.7 |
| 5'' (CH) | 78.2 |
| 6'' (CH2) | 63.2 |
