5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2~{S},3~{R},4~{R},5~{S},6~{R})-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-6-[(2~{S},3~{S},4~{S},5~{S})-3,4,5-trihydroxytetrahydropyran-2-yl]chromen-4-one

CNP0354243.9 · C26H28O14 · View on COCONUT ↗

2D Structure

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Identifiers

IUPAC Name	5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2~{S},3~{R},4~{R},5~{S},6~{R})-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-6-[(2~{S},3~{S},4~{S},5~{S})-3,4,5-trihydroxytetrahydropyran-2-yl]chromen-4-one
COCONUT ID	CNP0354243.9
InChIKey	OVMFOVNOXASTPA-ZUGZFPASSA-N
InChI	InChI=1S/C26H28O14/c27-6-13-18(32)21(35)23(37)26(40-13)16-20(34)15(25-22(36)17(31)11(30)7-38-25)19(33)14-10(29)5-12(39-24(14)16)8-1-3-9(28)4-2-8/h1-5,11,13,17-18,21-23,25-28,30-37H,6-7H2/t11-,13+,17-,18+,21-,22-,23+,25-,26-/m0/s1
SMILES	O=C1C=C(C2=CC=C(O)C=C2)OC2=C([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)=C([C@@H]3OC[C@H](O)[C@H](O)[C@@H]3O)C(O)=C12

Properties

Molecular Formula	C26H28O14
Molecular Weight	564.50
Exact Mass	564.14791
Log P (ALogP)	-1.75
TPSA	250.97
H-Bond Donors / Acceptors	10 / 14
Rotatable Bonds	4
Lipinski's Rule of 5 Violations	3
QED Drug-likeness	0.17
NP-likeness	1.96

Classification

NP Pathway	Shikimates and Phenylpropanoids
NP Superclass	Flavonoids
NP Class	Flavones
Chemical Superclass	Phenylpropanoids and polyketides
Chemical Class	Flavonoids
Chemical Subclass	Flavonoid glycosides

Reported in GR-MAPs Plants

Glycyrrhiza glabra	as “Glycyrrhiza glabra” in COCONUT

References (12)

Data from COCONUT (COlleCtion of Open Natural prodUcTs), released under CC0. Chandrasekhar V. et al. COCONUT 2.0: a comprehensive overhaul and curation of the collection of open natural products database. Nucleic Acids Research (2024), doi:10.1093/nar/gkae1063. COCONUT release 2026-10.

COCONUT Compound