Products for Research Use Only
RegisterLogin

Epimagnolin A

CAT: 0931-TN1610-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-TN1610-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
41689-51-4
Target
Parasite
Related Pathways
Microbiology/Virology
Purity
0.9982
Bioactivity
Epimagnolin A is a lignan obtained from the flower buds of Magnolia fargesii, which is traditionally used in Asian medicine for treating headache and nasal congestion.
Smiles
[H][C@]12CO[C@@H](c3cc(OC)c(OC)c(OC)c3)[C@@]1([H])CO[C@@H]2c1ccc(OC)c(OC)c1
Molecular Formula
C23H28O7
Molecular Weight
416.46
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Epimagnolin A

(1S,3aR,4R,6aR)-1-(3,4-Dimethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)hexahydrofuro[3,4-c]furan has been reported in Hernandia guianensis, Hernandia ovigera, and other organisms with data available.

CAS Number41689-51-4
PubChem CID13889713
IUPAC Name(3S,3aR,6R,6aR)-3-(3,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan
Molecular FormulaC23H28O7
Molecular Weight416.5
XLogP2.9
Topological Polar Surface Area64.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count30
Formal Charge0
Complexity532
SMILES
COC1=C(C=C(C=C1)[C@@H]2[C@H]3CO[C@H]([C@H]3CO2)C4=CC(=C(C(=C4)OC)OC)OC)OC
InChI
InChI=1S/C23H28O7/c1-24-17-7-6-13(8-18(17)25-2)21-15-11-30-22(16(15)12-29-21)14-9-19(26-3)23(28-5)20(10-14)27-4/h6-10,15-16,21-22H,11-12H2,1-5H3/t15-,16-,21+,22-/m0/s1
InChIKey
MFIHSKBTNZNJIK-FRMGNDQPSA-N
Chemical Structure
2D Structure
2D structure of Epimagnolin A
CAS: 41689-51-4
CID: 13889713
Formula: C23H28O7
MW: 416.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight416.5
XLogP32.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass416.18350323
Monoisotopic Mass416.18350323
Topological Polar Surface Area64.6 Ų
Heavy Atom Count30
Formal Charge0
Complexity532
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
GTR19156644-01Epimagnolin A
GTR19183708-01Epimagnolin B

Popular Products