(3R,4R)-3-hydroxy-3,4-bis[(4-hydroxy-3-methoxy-phenyl)methyl]oxolan-2- one

1. Names and Identifiers

1.1 Name: (3R,4R)-3-hydroxy-3,4-bis[(4-hydroxy-3-methoxy-phenyl)methyl]oxolan-2- one

1.5 Inchi: InChI=1/C20H22O7/c1-25-17-8-12(3-5-15(17)21)7-14-11-27-19(23)20(14,24)10-13-4-6-16(22)18(9-13)26-2/h3-6,8-9,14,21-22,24H,7,10-11H2,1-2H3/t14-,20-/s2

1.7 Canonical Smiles: COC1=CC(C[C@@H]2COC(=O)[C@@]2(O)CC2=CC=C(O)C(OC)=C2)=CC=C1O

2. Properties

3. Computed Properties

Molecular Weight：374.38448g/mol
Molecular Formula：C₂₀H₂₂O₇
Compound Is Canonicalized：True
XLogP3-AA：114.02810645
Monoisotopic Mass：114.02810645
Complexity：62.9
Rotatable Bond Count：0
Hydrogen Bond Donor Count：0
Hydrogen Bond Acceptor Count：2
Topological Polar Surface Area：0
Heavy Atom Count：：8
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：0
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADcYBgAYAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGQAAAAAACACAEAgwAIAAAACAACBCAAACAAAgAAAIiAAAAIgIICKAERCAIAAggAAIiAcAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==