Spektraris NMR
Ginsenoside PM1
Common Name: Ginsenoside PM1
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C52H92O9/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-25-42(55)59-34-38-44(56)45(57)46(58)47(60-38)61-52(9,29-23-24-35(2)3)36-26-31-51(8)43(36)37(53)33-40-49(6)30-28-41(54)48(4,5)39(49)27-32-50(40,51)7/h24,36-41,43-47,53-54,56-58H,10-23,25-34H2,1-9H3/t36-,37+,38+,39-,40+,41-,43-,44+,45-,46+,47-,49-,50+,51+,52-/m0/s1
InChIKey: InChIKey=PSTIZMSCBQJWHD-TZGWGJCVSA-N
Formula: C52H92O9
Molecular Weight: 861.28346
Exact Mass: 860.674135
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Lei, J., Li, X., Gong, X.J., Zheng, Y.N. Molecules (2007) 12, 2140-50
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) | 28.2 |
| 3 (CH) | 78 |
| 4 (C) | 39.4 |
| 5 (CH) | 56.4 |
| 6 (CH2) | 18.7 |
| 7 (CH2) | 35.2 |
| 8 (C) | 39.5 |
| 9 (CH) | 50.3 |
| 10 (C) | 37.3 |
| 11 (CH2) | 30.7 |
| 12 (CH) | 70.1 |
| 13 (CH) | 49.5 |
| 14 (C) | 51.4 |
| 15 (CH2) | 31 |
| 16 (CH2) | 26.7 |
| 17 (CH) | 51.6 |
| 18 (CH3) | 16.3 |
| 19 (CH3) | 16 |
| 20 (C) | 83.4 |
| 21 (CH3) | 22.9 |
| 22 (CH2) | 36.1 |
| 23 (CH2) | 23 |
| 24 (CH) | 126 |
| 25 (C) | 130.9 |
| 26 (CH3) | 25.8 |
| 27 (CH3) | 17.8 |
| 28 (CH3) | 28.6 |
| 29 (CH3) | 16.3 |
| 30 (CH3) | 17.4 |
| 1'' (CH) | 98 |
| 2'' (CH) | 75 |
| 3'' (CH) | 79.2 |
| 4'' (CH) | 71.6 |
| 5'' (CH) | 78 |
| 6'' (CH2) | 64.6 |
| 6''a (C) | 173.5 |
| 6''b (CH2) | 34.4 |
| 6''c (CH2) | 25.3 |
| 6''d (CH2) | 29.4 |
| 6''e (CH2) | 28.2 |
| 6''f (CH2) | 29.6 |
| 6''g (CH2) | 30 |
| 6''h (CH2) | 30 |
| 6''i (CH2) | 30 |
| 6''j (CH2) | 30 |
| 6''k (CH2) | 30 |
| 6''l (CH2) | 29.6 |
| 6''m (CH2) | 29.8 |
| 6''n (CH2) | 32.1 |
| 6''o (CH2) | 22.1 |
| 6''p (CH3) | 14.2 |
