SDS FinderConcentration Calculator
Name
trans-Pterostilbene
CAS
537-42-8
Synonyms
Molecular formula
C16H16O3
Average molecular weight
256.3
Monoisotopic mass of parent ion
256.1099
Verified Purity
98.7
Solubility
N/A
Spectra
Chromatogram

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mg
g/mol
mM

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mM
g/mol
mL

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g/mol
mL
mg
g/mol
(%)
Chloroform
100
80
60
40
20
0
0
20
40
60
80
100
MeOH
(%)
(%)
H2O
100
80
60
40
20
0
0
20
40
60
80
100
MeOH
(%)
(%)
H2O
100
80
60
40
20
0
0
20
40
60
80
100
DMSO
(%)
H2O (pH)
9
8
7
6
5
4
3

Information

Version
5.0
Status
Expected but not Quantified
HMDB Name
4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]phenol
SMILES
[H]\C(=C(\[H])C1=CC(OC)=CC(OC)=C1)C1=CC=C(O)C=C1
Description
4-[(e)-2-(3,5-dimethoxyphenyl)ethenyl]phenol is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 1,3-dimethoxy-5-(2-phenylethenyl)benzene. It is generated by cyp1a2, cyp2c9, and cyp2d6 enzymes via a hydroxylation-of-benzene-para-to-edg reaction. This hydroxylation-of-benzene-para-to-edg occurs in humans.

Physical Properties

State

Experimental Properties

Property
Value
Reference
Melting Point
Boiling Point
Water Solubility
LogP

Biological Properties

Cellular Locations
N/A
Biospecimen Locations
N/A
Tissue Locations
N/A

Normal Concentrations

Biospecimen
Status
Value
Age
Sex
Condition
Reference
Details
None available

Abnormal Concentrations

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Status
Value
Age
Sex
Condition
Reference
Details
None available

Spectra

Type
Description
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Pathways

Name
SMPDB / Pathwhiz
KEGG
None available