Products for Research Use Only
RegisterLogin

Pinoresinol

CAT: 0607-BA3016-10Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0607-BA3016-10Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
487-36-5
Form
A solid
Molecular Formula
C20H22O6
Molecular Weight
358.39
Shipping Conditions
Blue ice
Storage Conditions
4°C, protect from light.

Chemical Information

(+)-Pinoresinol

(+)-pinoresinol is an enantiomer of pinoresinol having (+)-1S,3aR,4S,6aR-configuration. It has a role as a hypoglycemic agent, a plant metabolite and a phytoestrogen.

CAS Number487-36-5
PubChem CID73399
IUPAC Name4-[(3S,3aR,6S,6aR)-6-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol
Molecular FormulaC20H22O6
Molecular Weight358.4
XLogP2.3
Topological Polar Surface Area77.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity431
SMILES
COC1=C(C=CC(=C1)[C@@H]2[C@H]3CO[C@@H]([C@H]3CO2)C4=CC(=C(C=C4)O)OC)O
InChI
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+/m0/s1
InChIKey
HGXBRUKMWQGOIE-AFHBHXEDSA-N
Chemical Structure
2D Structure
2D structure of (+)-Pinoresinol
CAS: 487-36-5
CID: 73399
Formula: C20H22O6
MW: 358.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight358.4
XLogP32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass358.14163842
Monoisotopic Mass358.14163842
Topological Polar Surface Area77.4 Ų
Heavy Atom Count26
Formal Charge0
Complexity431
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
M24442-01Pinoresinol
GDA44629-01(-) -Pinoresinol
TN5415(±) -Pinoresinol
MBS3617681-01(-)-Pinoresinol
573983(+)-Pinoresinol
FP65785-01(+) -Pinoresinol
MBS5787533(+/-)-Pinoresinol

Popular Products