Spektraris NMR
Floralginsenoside C
Common Name: Floralginsenoside C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C41H70O15/c1-19(2)24(56-51)10-14-41(8,55-36-33(50)31(48)30(47)25(54-36)18-53-35-32(49)29(46)23(44)17-52-35)20-9-13-39(6)28(20)21(42)15-26-38(5)12-11-27(45)37(3,4)34(38)22(43)16-40(26,39)7/h20-36,42-51H,1,9-18H2,2-8H3/t20-,21+,22-,23-,24?,25+,26+,27-,28-,29-,30+,31-,32+,33+,34-,35-,36-,38+,39+,40+,41-/m0/s1
InChIKey: InChIKey=DBARXZWYGPCWKH-SQESOWRGSA-N
Formula: C41H70O15
Molecular Weight: 802.987098
Exact Mass: 802.471472
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) | 39.4 |
| 2 (CH2) | 28.1 |
| 3 (CH) | 78.6 |
| 4 (C) | 40.3 |
| 5 (CH) | 61.8 |
| 6 (CH) | 67.8 |
| 7 (CH2) | 47.5 |
| 8 (C) | 41.2 |
| 9 (CH) | 50 |
| 10 (C) | 39.4 |
| 11 (CH2) | 30.9 |
| 12 (CH) | 70.2 |
| 13 (CH) | 49.2 |
| 14 (C) | 51.4 |
| 15 (CH2) | 30.8 |
| 16 (CH2) | 26.7 |
| 17 (CH) | 52.1 |
| 18 (CH3) | 17.4 |
| 19 (CH3) | 17.5 |
| 20 (C) | 83.3 |
| 21 (CH3) | 21.8 |
| 22 (CH2) | 32.8 |
| 23 (CH2) | 26.7 |
| 24 (CH) | 90.1 |
| 25 (C) | 146.2 |
| 26 (CH2) | 113.3 |
| 27 (CH3) | 17.8 |
| 28 (CH3) | 32 |
| 29 (CH3) | 16.5 |
| 30 (CH3) | 17.6 |
| 1' (CH) | 98 |
| 2' (CH) | 74.9 |
| 3' (CH) | 79.4 |
| 4' (CH) | 72.1 |
| 5' (CH) | 76.4 |
| 6' (CH2) | 69.5 |
| 1'' (CH) | 105.1 |
| 2'' (CH) | 72.2 |
| 3'' (CH) | 74.2 |
| 4'' (CH) | 68.8 |
| 5'' (CH2) | 66 |
