Spektraris NMR
ginsenoside Rh1
Common Name: ginsenoside Rh1
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C36H62O9/c1-19(2)10-9-13-36(8,43)20-11-15-34(6)26(20)21(38)16-24-33(5)14-12-25(39)32(3,4)30(33)22(17-35(24,34)7)44-31-29(42)28(41)27(40)23(18-37)45-31/h10,20-31,37-43H,9,11-18H2,1-8H3/t20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,30-,31+,33+,34+,35+,36-/m0/s1
InChIKey: InChIKey=RAQNTCRNSXYLAH-RFCGZQMISA-N
Formula: C36H62O9
Molecular Weight: 638.873463
Exact Mass: 638.439384
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Komakine, N., Okasaka, M., Takaishi, Y., Kawazoe, K., Murakami, K., Yamada, Y. J Nat Med (2006) 60, 135-7
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) | 39.5 |
| 2 (CH2) | 28 |
| 3 (CH) | 78.7 |
| 4 (C) | 40.4 |
| 5 (CH) | 61.5 |
| 6 (CH) | 80.1 |
| 7 (CH2) | 45.3 |
| 8 (C) | 41.2 |
| 9 (CH) | 50.3 |
| 10 (C) | 39.8 |
| 11 (CH2) | 32.1 |
| 12 (CH) | 71.1 |
| 13 (CH) | 48.4 |
| 14 (C) | 51.7 |
| 15 (CH2) | 31.3 |
| 16 (CH2) | 26.7 |
| 17 (CH) | 54.8 |
| 18 (CH3) | 17.5 |
| 19 (CH3) | 17.7 |
| 20 (C) | 73.2 |
| 21 (CH3) | 27.1 |
| 22 (CH2) | 35.9 |
| 23 (CH2) | 23.1 |
| 24 (CH) | 126.4 |
| 25 (C) | 130.8 |
| 26 (CH3) | 25.9 |
| 27 (CH3) | 17.7 |
| 28 (CH3) | 31.8 |
| 29 (CH3) | 16.4 |
| 30 (CH3) | 16.9 |
| 1' (CH) | 106 |
| 2' (CH) | 75.6 |
| 3' (CH) | 79.6 |
| 4' (CH) | 72.1 |
| 5' (CH) | 78.1 |
| 6' (CH2) | 63.3 |
