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Justiciresinol structure
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Justiciresinol

TL;DR: Justiciresinol (CAS 136051-41-7) is a chemical compound with molecular formula C21H26O7 and molecular weight 390.16785 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[[(3R,4R,5S)-5-(4-hydroxy-3-methoxyphenyl)-4-(hydroxymethyl)oxolan-3-yl]methyl]-2,6-dimethoxyphenol

Also Known As: Justiciresinol, Jusglaucinol, (+)-Justiciresinol, J2.540.194H, 2-(4-Hydroxy-3-methoxyphenyl)-4-((4-hydroxy-3,5-dimethoxyphenyl)methyl)-tetrahydrofuran-3-methanol

CAS Number
136051-41-7
Molecular Formula
C21H26O7
Molecular Weight
390.16785 g/mol
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Technical Specifications

Molecular FormulaC21H26O7
Molecular Weight390.16785 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)97.6 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors7
Rotatable Bonds7
Exact Mass390.16785 Da
Heavy Atoms28
Complexity462.0
SMILESCOC1=CC(=CC(=C1O)OC)C[C@H]2CO[C@@H]([C@H]2CO)C3=CC(=C(C=C3)O)OC
InChIKeyLNRXVGSOOWBFAI-VFCRVFHLSA-N

Chemical Property Profile of Justiciresinol

XLogP
2.4
TPSA (Topological Polar Surface Area)
97.6
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
7
Rotatable Bonds
7
Heavy Atoms
28
Complexity
462.0
Exact Mass
390.16785
Monoisotopic Mass
390.16785
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Justiciresinol

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Justiciresinol. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Justiciresinol. Following Lipinski's Rule of Five, Justiciresinol has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Justiciresinol?

The CAS number of Justiciresinol is 136051-41-7.

What is the molecular formula of Justiciresinol?

The molecular formula of Justiciresinol is C21H26O7.

What is the molecular weight of Justiciresinol?

The molecular weight of Justiciresinol is 390.16785 g/mol.

Where can I buy Justiciresinol?

You can request a quote for Justiciresinol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Justiciresinol?

Yes, CoreyChem provides custom synthesis services for Justiciresinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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