Ginsenoside-F4
From Metabolomics.JP
Upper classes
IDs and Links | |
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LipidBank | [1] |
LipidMaps | [2] |
CAS | 126223-28-7 |
KEGG | {{{KEGG}}} |
KNApSAcK | |
CDX file | |
MOL file | Ginsenoside-F4.mol |
Ginsenoside F4 | |
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Structural Information | |
Systematic Name | (3beta,6alpha,12beta,20Z)-3,12-Dihydroxydammara-20(22),24-dien-6-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside |
Common Name |
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Symbol | |
Formula | C42H70O12 |
Exact Mass | 766.486727704 |
Average Mass | 766.9979999999999 |
SMILES | C(C1O)(C(OC(OC(C2OC(C34)CC(C)(C56C)C(CC(O)C5C(C(C) |
Physicochemical Information | |
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Spectral Information | |
Mass Spectra | |
UV Spectra | |
IR Spectra | |
NMR Spectra | |
Chromatograms |
Spectroscopic Data
M.P. | 177 - 180 °C |
IR (KBr) | 3400 (OH), 2900 (CH), 1630 (C=C), 1080 (C-O) cm-1 |
1H-NMR (C5D5N, 100 MHz) | 0.98 (s, 3xH-19), 1.27 (s, 3xH-28), 1.37 (s, 3xH-30), 1.45 (d, J=6.5 Hz, CH3 of Rha), 1.59, 1.64 (3xH-26 and 3xH-27), 1.81 (3xH-21), 2.14 (s, 3xH-29), 4.81 (d, J=2.4 Hz, H-1 of Rha), 5.25 (brt, J=6.0 Hz, H-24), 5.28 (d, J=7.5 Hz, H-1 of Glc), 5.48 (brt, J=6.0 Hz, H-22) |
13C-NMR (C5D5N, 27.5MHz) | C-1) 39.5, (2) 27.8, (3) 78.4, (4) 40.1, (5) 60.9, (6) 74.4, (7) 46.2, (8) 41.4, (9) 50.1, (10) 40.0, (11) 32.2, (12) 70.3, (13) 50.7, (14) 50.9, (15) 32.6, (16) 27.1, (17) 52.0, (18) 17.7, (19) 17.8, (20) 140.1, (21) 27.5, (22) 123.5, (23) 230.0, (24) 125.4, (25) 131.3, (26) 25.8, (27) 17.6, (28) 32.6, (29) 17.0, (30) 17.2 Glc (1) 101.8, (2) 79.5, (3) 78.4, (4) 72.6, (5) 78.4, (6) 63.2 Rha (1) 102.0, (2) 72.3, (3) 72.4 , (4) 74.2, (5) 69.5, (6) 18.80 |
Y. Ogihara et al., Planta Med., 56, 298 (1990).