precursor metabolite

Showing entry for Resveratrol (cis-)

Identification

PhytoHub ID
PHUB000335
Name
Resveratrol (cis-)
Systematic Name
Not Available
Synonyms
  • (Z)-resveratrol
  • cis-3,4',5-trihydroxystilbene
CAS Number
Not Available
Average Mass
228.247
Monoisotopic Mass
228.078644246
Chemical Formula
C14H12O3
IUPAC Name
cis-resveratrol
InChI Key
LUKBXSAWLPMMSZ-UPHRSURJSA-N
InChI Identifier
InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1-
SMILES
[H]\C(=C(/[H])C1=CC(O)=CC(O)=C1)C1=CC=C(O)C=C1
Structure
Similar Structures

Calculated Properties

Solubility (ALOGPS)
6.88e-02 g/l
LogS (ALOGPS)
-3.52
LogP (ALOGPS)
2.57
Hydrogen Acceptors
3
Hydrogen Donors
3
Rotatable Bond Count
2
Polar Surface Area
60.69
Refractivity
67.45550000000001
Polarizability
23.64697428169282
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-5.678025720766968
pKa (strongest acidic)
8.993489164415603
Number of Rings
2
Rule of Five
Yes
Bioavailability
Yes
Ghose Filter
Yes
Veber's Rule
No
MDDR-like Rule
No

Taxonomy

Family
Polyphenols
Class
Stilbenes
Sub-class
Not Available

Spectra

Record IDSourceDescriptionView
BML00641MassBankLC-ESI-QTOF Spectrum - 10 ev, unspecifiedView Spectra
BML00673MassBankLC-ESI-QTOF Spectrum - 10 ev, unspecifiedView Spectra
BML00681MassBankLC-ESI-QTOF Spectrum - 20 ev, unspecifiedView Spectra
BML00689MassBankLC-ESI-QTOF Spectrum - 40 ev, unspecifiedView Spectra
BML82055MassBankLC-ESI-QTOF Spectrum - -, unspecifiedView Spectra
BML82056MassBankLC-ESI-QTOF Spectrum - -, unspecifiedView Spectra
CE000093MassBankLC-ESI-ITFT Spectrum - 35eV, unspecifiedView Spectra
CE000094MassBankLC-ESI-ITFT Spectrum - 45eV, unspecifiedView Spectra
CE000095MassBankLC-ESI-ITFT Spectrum - 55eV, unspecifiedView Spectra
CE000096MassBankLC-ESI-ITFT Spectrum - 70eV, unspecifiedView Spectra
CE000097MassBankLC-ESI-ITFT Spectrum - -, unspecifiedView Spectra
PB000641MassBankLC-ESI-QTOF Spectrum - 15 eV, unspecifiedView Spectra
PB000642MassBankLC-ESI-QTOF Spectrum - 25 eV, unspecifiedView Spectra
PB000643MassBankLC-ESI-QTOF Spectrum - 40 eV, unspecifiedView Spectra
PB000661MassBankLC-ESI-QTOF Spectrum - 55 eV, unspecifiedView Spectra
PB002421MassBankLC-ESI-QTOF Spectrum - 15 eV, unspecifiedView Spectra
PB002422MassBankLC-ESI-QTOF Spectrum - 25 eV, unspecifiedView Spectra
PB002423MassBankLC-ESI-QTOF Spectrum - 40 eV, unspecifiedView Spectra
PB002424MassBankLC-ESI-QTOF Spectrum - 55 eV, unspecifiedView Spectra
PB003661MassBankLC-ESI-QQ Spectrum - 20 eV, unspecifiedView Spectra
PB003662MassBankLC-ESI-QQ Spectrum - 25 eV, unspecifiedView Spectra
PB006261MassBankLC-ESI-QTOF Spectrum - 10 eV, unspecifiedView Spectra
PB006262MassBankLC-ESI-QTOF Spectrum - 15 eV, unspecifiedView Spectra
PB006263MassBankLC-ESI-QTOF Spectrum - 20 eV, unspecifiedView Spectra

Food Sources

NameGroup
Apple juiceBeverages, Non-alcoholic PublicationsShow
BeerBeverages, Alcoholic PublicationsShow
Black teaTeas and herbal teas PublicationsShow
Camomile teaTeas and herbal teas PublicationsShow
Ceylon teaTeas and herbal teas PublicationsShow
CranberryFruit, Berries PublicationsShow
Cranberry juiceBeverages, Non-alcoholic PublicationsShow
Dessert wineBeverages, Alcoholic PublicationsShow
Green teaTeas and herbal teas PublicationsShow
Peach juiceBeverages, Non-alcoholic PublicationsShow
PistachioNuts PublicationsShow
Red grape juiceBeverages, Non-alcoholic PublicationsShow
Red teaTeas and herbal teas PublicationsShow
Red wineBeverages, Alcoholic PublicationsShow
Red wine grapeFruit, Berries PublicationsShow
Rosé wineBeverages, Alcoholic PublicationsShow
Tilia teaTeas and herbal teas PublicationsShow
TomatoVegetables, Fruit vegetables PublicationsShow
White grape juiceBeverages, Non-alcoholic PublicationsShow
White wineBeverages, Alcoholic PublicationsShow
White wine grapeFruit, Berries PublicationsShow
PrecursorFood SourceFood Source Group
Piceid (cis-)AppleFruit, Pomes PublicationsShow
Resveratrol (trans-)Apple juiceBeverages, Non-alcoholic PublicationsShow
Resveratrol (trans-)BeerBeverages, Alcoholic PublicationsShow
Piceid (cis-)BeerBeverages, Alcoholic PublicationsShow
Resveratrol (trans-)BilberryFruit, Berries PublicationsShow
Resveratrol (trans-)Black teaTeas and herbal teas PublicationsShow
Resveratrol (trans-)BlueberryFruit, Berries PublicationsShow
Resveratrol (trans-)Camomile teaTeas and herbal teas PublicationsShow
Resveratrol (trans-)Ceylon teaTeas and herbal teas PublicationsShow
Resveratrol (trans-)ChocolateCocoa and cocoa products PublicationsShow
Resveratrol (trans-)Cocoa liquorCocoa and cocoa products PublicationsShow
Resveratrol (trans-)CoffeeCoffee and coffee products PublicationsShow
Resveratrol (trans-)CranberryFruit, Berries PublicationsShow
Resveratrol (trans-)Cranberry juiceBeverages, Non-alcoholic PublicationsShow
Resveratrol (trans-)DeerberryFruit, Berries PublicationsShow
Resveratrol (trans-)Dessert wineBeverages, Alcoholic PublicationsShow
Resveratrol (trans-)European cranberryFruit, Berries PublicationsShow
PinosylvinGrapeFruit, Berries PublicationsShow
Resveratrol (trans-)Green teaTeas and herbal teas PublicationsShow
Resveratrol (trans-)Itadori teaTeas and herbal teas PublicationsShow
Resveratrol (trans-)LingonberryFruit, Berries PublicationsShow
Piceid (cis-)LingonberryFruit, Berries PublicationsShow
Resveratrol (trans-)MulberryFruit, Berries PublicationsShow
Resveratrol (trans-)Partridge berryFruit, Berries PublicationsShow
Resveratrol (trans-)Peach juiceBeverages, Non-alcoholic PublicationsShow
Resveratrol (trans-)PeanutNuts PublicationsShow
PinosylvinPeanutNuts PublicationsShow
Resveratrol (trans-)PistachioNuts PublicationsShow
Piceid (cis-)PistachioNuts PublicationsShow
Resveratrol (trans-)PomaceFruit, Other fruits PublicationsShow
Resveratrol (trans-)Red champagneBeverages, Alcoholic PublicationsShow
Resveratrol (trans-)Red grape juiceBeverages, Non-alcoholic PublicationsShow
Piceid (cis-)Red grape juiceBeverages, Non-alcoholic PublicationsShow
Resveratrol (trans-)Red teaTeas and herbal teas PublicationsShow
Resveratrol (trans-)Red wineBeverages, Alcoholic PublicationsShow
Piceid (cis-)Red wineBeverages, Alcoholic PublicationsShow
Resveratrol (trans-)Red wine grapeFruit, Berries PublicationsShow
Resveratrol (trans-)Rosé wineBeverages, Alcoholic PublicationsShow
Piceid (cis-)Rosé wineBeverages, Alcoholic PublicationsShow
Resveratrol (trans-)SparkleberryFruit, Berries PublicationsShow
Piceid (cis-)StrawberryFruit, Berries PublicationsShow
Resveratrol (trans-)Tilia teaTeas and herbal teas PublicationsShow
Resveratrol (trans-)TomatoVegetables, Fruit vegetables PublicationsShow
Piceid (cis-)TomatoVegetables, Fruit vegetables PublicationsShow
Resveratrol (trans-)White grape juiceBeverages, Non-alcoholic PublicationsShow
Piceid (cis-)White grape juiceBeverages, Non-alcoholic PublicationsShow
Resveratrol (trans-)White wineBeverages, Alcoholic PublicationsShow
Piceid (cis-)White wineBeverages, Alcoholic PublicationsShow
Resveratrol (trans-)White wine grapeFruit, Berries PublicationsShow

Metabolism

PrecursorMetaboliteSpeciesBiofluidsOriginFormulaMonoisotopic mass
Resveratrol (cis-) Piceid (cis-)human zebrafishLDL, plasma, urinehost metabolismC20H22O8390.131467668 Publications
Resveratrol (trans-) Resveratrol (cis-)pig zebrafishblood, cerebellum, colon tissue, colorectal tissue, duodenum tissue, ileum tissue, jejunum tissue, LDL, plasma, stomach, urinehost metabolismC14H12O3228.078644246 Publications
Piceid (cis-) Resveratrol (cis-)zebrafishNot Availablehost metabolismC14H12O3228.078644246 Publications
Pinosylvin Resveratrol (cis-)ratplasmahost metabolismC14H12O3228.078644246 Publications
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