Steppogenin

Base Information

• Chemical Name: Steppogenin
• CAS No.: 56486-94-3
• Molecular Formula: C15H12O6
• Molecular Weight: 288.25
• DSSTox Substance ID: DTXSID101318233
• Nikkaji Number: J972.239D
• Wikidata: Q105217903
• Pharos Ligand ID: 6VMC63CL836C
• Metabolomics Workbench ID: 135714
• ChEMBL ID: CHEMBL458395
• Mol file: 56486-94-3.mol

Synonyms:steppogenin

Chemical Property of Steppogenin

Chemical Property:

• PSA: 107.22000
• LogP: 2.21550
• XLogP3: 2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 288.06338810
• Heavy Atom Count: 21
• Complexity: 400

Purity/Quality:

98.5% ^*data from raw suppliers

Steppogenin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=C(C=C(C=C3)O)O
• Isomeric SMILES: C1[C@H](OC2=CC(=CC(=C2C1=O)O)O)C3=C(C=C(C=C3)O)O

Technology Process of Steppogenin

There total 6 articles about Steppogenin 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: 78.0%

2'-hydroxy-2,4,4',6'-tetrakis(methoxymethoxy)chalcone (134955-33-2) → 5,7,2′,4′-tetrahydroxyflavanone (121694-88-0,56486-94-3)

Guidance literature:

With hydrogenchloride; In methanol; for 0.166667h; Heating;

DOI:10.1016/j.bmc.2007.01.017

Reference yield:

2'-hydroxy-4',6'-bis(methoxymethoxy)acetophenone (65490-09-7) → 5,7,2′,4′-tetrahydroxyflavanone (121694-88-0,56486-94-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 52 percent / KOH / H₂O; methanol / 36 h / 20 °C

2: 78 percent / hydrochloric acid / methanol / 0.17 h / Heating

With hydrogenchloride; potassium hydroxide; In methanol; water; 1: Claisen-Schmidt condensation;

DOI:10.1016/j.bmc.2007.01.017

Reference yield:

2,4-bis(methoxymethoxy)benzaldehyde (13709-06-3) → 5,7,2′,4′-tetrahydroxyflavanone (121694-88-0,56486-94-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 52 percent / KOH / H₂O; methanol / 36 h / 20 °C

2: 78 percent / hydrochloric acid / methanol / 0.17 h / Heating

With hydrogenchloride; potassium hydroxide; In methanol; water; 1: Claisen-Schmidt condensation;

DOI:10.1016/j.bmc.2007.01.017

upstream raw materials:

2'-hydroxy-2,4,4',6'-tetrakis(methoxymethoxy)chalcone

2'-hydroxy-4',6'-bis(methoxymethoxy)acetophenone

2,4-bis(methoxymethoxy)benzaldehyde

Refernces

• 1、 El-Sohly,Joshi,Li,Ross. "Flavonoids from Maclura tinctoria". . p. 141 - 145. Retrieved 1999.
• 2、 -. "Aromatase inhibitors from Broussonetia papyrifera". . . Retrieved 2008/06/13.