Identification

PhytoHub ID
PHUB001389
Name
(+)-Pinoresinol
Synonyms
Not Available
CAS Number
Not Available
Average Mass
358.39
Monoisotopic Mass
358.141638428
Chemical Formula
C20H22O6
IUPAC Name
Not Available
InChI Key
HGXBRUKMWQGOIE-NSMLZSOPSA-N
InChI Identifier
InChI=1S/C20H22O6/c1-23-17-7-11(3-5-15(17)21)19-13-9-26-20(14(13)10-25-19)12-4-6-16(22)18(8-12)24-2/h3-8,13-14,19-22H,9-10H2,1-2H3/t13-,14-,19+,20+/m1/s1
SMILES
[H][C@@]12CO[C@@H](C3=CC=C(O)C(OC)=C3)[C@]1([H])CO[C@H]2C1=CC(OC)=C(O)C=C1
Structure

Calculated Properties

Solubility (ALOGPS)
3.09e-02 g/l
LogS (ALOGPS)
-4.06
LogP (ALOGPS)
2.31
Hydrogen Acceptors
6
Hydrogen Donors
2
Rotatable Bond Count
4
Polar Surface Area
77.38000000000001
Refractivity
95.10020000000003
Polarizability
38.046904078057665
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-3.803528853893933
pKa (strongest acidic)
9.60971679801834
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Taxonomy

Family
Polyphenols
Class
Lignans
Sub-class
Not Available

Spectra

No spectra information available

Food Sources

NameGroup
ApricotFruit, Drupes PublicationsShow
BroccoliVegetables, Cabbages PublicationsShow
Brussel sproutsVegetables, Cabbages PublicationsShow
Common cabbageVegetables, Cabbages PublicationsShow
FlaxseedOilseed crops PublicationsShow
GarlicHerbs and Spices PublicationsShow
GrapefruitFruit, Citrus PublicationsShow
KaleVegetables, Cabbages PublicationsShow
Multigrain breadCereals and cereal products PublicationsShow
NectarineFruit, Drupes PublicationsShow
Olive oilFats and oils PublicationsShow
PeachFruit, Drupes PublicationsShow
PearFruit, Pomes PublicationsShow
Rye breadCereals and cereal products PublicationsShow
SesameOilseed crops PublicationsShow
StrawberryFruit, Berries PublicationsShow
SunflowerOilseed crops PublicationsShow
Sweet orangeFruit, Citrus PublicationsShow
TomatoVegetables, Fruit vegetables PublicationsShow
Whole wheat breadCereals and cereal products PublicationsShow

Metabolism

No metabolism information available

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