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Chemical structure of 5'''-O-Feruloyl complanatoside B

GC68564

5'''-O-Feruloyl complanatoside B

Also known as [(3S,4R,5S)-5-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-[5-hydroxy-7-methoxy-4-oxo-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-3-yl]oxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxolan-3-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

5''-O-Feruloyl complanatoside B can be isolated from the seeds of Astragalus complanatus· Astragalus polysaccharides (SAC) contain fatty acids, amino acids, polysaccharides, flavonoids, triterpenoid saponins and trace elements; it has been reported to be associated with chronic diseases such as cardiovascular disease, diabetes and cancer

ChemicalCAS142473-98-1MW932.83FormulaC43H48O23
CAS number
142473-98-1
Molecular weight
932.83
Formula
C43H48O23
InChIKey
UTPCLOFGDXGRFY-KVDBRUDJSA-N
Catalogue number
GC68564
Brand
GLPBIO
Computed properties PubChem CID 145874197 · XLogP -0.3 · TPSA 349 Ų · H-bond donors 11
XLogP
-0.3
TPSA
349 Ų
H-bond donors
11
H-bond acceptors
23
Rotatable bonds
16
Heavy atoms
66

SMILES COC1=CC(=C2C(=C1)OC(=C(C2=O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O[C@H]4[C@@H]([C@](CO4)(COC(=O)/C=C/C5=CC(=C(C=C5)O)OC)O)O)C6=CC=C(C=C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O

Computed descriptors from PubChem (CID 145874197), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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