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Chemical structure of 20-Gluco-ginsenoside-Rf

GC72072

20-Gluco-ginsenoside-Rf

Also known as (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-2-[[(6R,10R,12S,14R,17S)-3,12-dihydroxy-4,4,10,14,15-pentamethyl-17-[(2S)-6-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhept-5-en-2-yl]-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

20-Gluco-ginsenoside-Rf (compound 4) is a bisdesmosidic saponin that can be obtained from the roots of Panax ginseng

ChemicalCAS68406-27-9MW963.15FormulaC48H82O19
CAS number
68406-27-9
Molecular weight
963.15
Formula
C48H82O19
InChIKey
KVHFYBWKXJPMMM-MGBLTDNXSA-N
Catalogue number
GC72072
Brand
GLPBIO
Computed properties PubChem CID 3052077 · XLogP 0.9 · TPSA 318 Ų · H-bond donors 13
XLogP
0.9
TPSA
318 Ų
H-bond donors
13
H-bond acceptors
19
Rotatable bonds
13
Heavy atoms
67

SMILES CC1C[C@@H](C2[C@]1(C3C[C@H](C4[C@@](C3C[C@@H]2O)(CCC(C4(C)C)O)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)[C@](C)(CCC=C(C)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O

Computed descriptors from PubChem (CID 3052077), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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