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5-Methoxyisolariciresinol

CAT: 0931-TN3126Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-TN3126Size:5 mg
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CAS Number
136082-41-2
Target
Others
Related Pathways
Others
Bioactivity
(+) -5-Methoxyisolariciresinol displays significant antioxidant activities, with the IC (50) value in the range of ca. 42 to 49 microg/ml.
Smiles
COc1cc(ccc1O)[C@@H]1[C@@H](CO)[C@H](CO)Cc2cc(OC)c(O)c(OC)c12
Molecular Formula
C21H26O7
Molecular Weight
390.43
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(+)-8-Methoxyisolariciresinol

(+)-8-Methoxyisolariciresinol has been reported in Salacia chinensis and Annona squamosa with data available.

CAS Number136082-41-2
PubChem CID10249800
IUPAC Name(6R,7R,8S)-8-(4-hydroxy-3-methoxyphenyl)-6,7-bis(hydroxymethyl)-1,3-dimethoxy-5,6,7,8-tetrahydronaphthalen-2-ol
Molecular FormulaC21H26O7
Molecular Weight390.4
XLogP2
Topological Polar Surface Area109
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count28
Formal Charge0
Complexity489
SMILES
COC1=C(C(=C2[C@@H]([C@H]([C@@H](CC2=C1)CO)CO)C3=CC(=C(C=C3)O)OC)OC)O
InChI
InChI=1S/C21H26O7/c1-26-16-7-11(4-5-15(16)24)18-14(10-23)13(9-22)6-12-8-17(27-2)20(25)21(28-3)19(12)18/h4-5,7-8,13-14,18,22-25H,6,9-10H2,1-3H3/t13-,14-,18+/m0/s1
InChIKey
ZPRAJLPWRSLALC-SUNYJGFJSA-N
Chemical Structure
2D Structure
2D structure of (+)-8-Methoxyisolariciresinol
CAS: 136082-41-2
CID: 10249800
Formula: C21H26O7
MW: 390.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight390.4
XLogP32
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass390.16785316
Monoisotopic Mass390.16785316
Topological Polar Surface Area109 Ų
Heavy Atom Count28
Formal Charge0
Complexity489
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
GTR191823725-Methoxyisolariciresinol
LFA08241-01(+) -8-Methoxyisolariciresinol
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234404-015,5,5-Trifluoronorvaline
PDA866615,5,5-Trifluoropentanonitrile
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