Erianin

Base Information

• Chemical Name: Erianin
• CAS No.: 95041-90-0
• Molecular Formula: C18H22O5
• Molecular Weight: 318.37
• Hs Code.: 29089990
• NSC Number: 613744
• DSSTox Substance ID: DTXSID40326751
• Nikkaji Number: J421.340H
• Wikidata: Q72486357
• Metabolomics Workbench ID: 121272
• ChEMBL ID: CHEMBL10557
• Mol file: 95041-90-0.mol

Synonyms:2-methoxy-5-(2-(3,4,5-trimethoxyphenyl)-ethyl)-phenol;2-methoxy-5-(2-(3,4,5-trimethoxyphenyl)ethyl)phenol;3-hydro-4,3',4',5'-quamythloxy-stilbene;dihydrocombretastatin A-4(1c);Eri cpd;Erianin;isoerianin

Chemical Property of Erianin

Chemical Property:

• Vapor Pressure: 2.54E-08mmHg at 25°C
• Boiling Point: 439.1°Cat760mmHg
• PKA: 9.99±0.10(Predicted)
• Flash Point: 219.4°C
• PSA: 57.15000
• Density: 1.147g/cm³
• LogP: 3.21180
• Storage Temp.: 2-8°C
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 318.14672380
• Heavy Atom Count: 23
• Complexity: 323

Purity/Quality:

99% ^*data from raw suppliers

Erianin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)CCC2=CC(=C(C(=C2)OC)OC)OC)O
• Uses: Erianin acts as a promising anticancer agent. Cytotoxic compound strongly inhibits tubulin polymerization in cell mitosis.

Technology Process of Erianin

There total 41 articles about Erianin which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

cis/trans isomer → erianin (95041-90-0)

Guidance literature:

With hydrogen; 5%-palladium/activated carbon; In ethanol; ethyl acetate; at 20 ℃; for 1h;

Reference yield: 100.0%

3'-benzyloxy-3,4,4',5-tetramethoxystilbene → erianin (95041-90-0)

Guidance literature:

With hydrogen; 5%-palladium/activated carbon; In ethanol; ethyl acetate; at 20 ℃; for 1h; Product distribution / selectivity;

Reference yield: 99.0%

combretastatin A-4 (438534-81-7) → erianin (95041-90-0)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethyl acetate;

DOI:10.1039/b702411h

upstream raw materials:

combrestatin A₄

combretastatin A-4

C₂₄H₃₆O₇SSi

(3,4,5-trimethoxyphenyl)methanol

Downstream raw materials:

3,4,5,4'-tetramethoxyl-α,β-diphenylethane-3'-O-sodium sulphate

C₁₈H₂₃O₈P

erianin acetate

Refernces

• 1、 -. "5-FLUOROURACIL DERIVATIVES, PREPARATION METHODS AND USES THEREOF". Paragraph 0116. . Retrieved 2021/07/30.
• 2、 -. "Orchid heterocyclic derivative as well as preparation method and application thereof". . . Retrieved 2021/10/16.