Hydrocortisone probutate

Base Information

• Chemical Name: Hydrocortisone probutate
• CAS No.: 72590-77-3
• Molecular Formula: C28H40 O7
• Molecular Weight: 488.621
• European Community (EC) Number: 276-726-9
• UNII: O6550D6K3A
• DSSTox Substance ID: DTXSID3048603
• Nikkaji Number: J68.592E
• Wikipedia: Hydrocortisone_buteprate
• NCI Thesaurus Code: C48023
• RXCUI: 27196
• Pharos Ligand ID: 5NAYLULYMGNV
• Metabolomics Workbench ID: 35414
• ChEMBL ID: CHEMBL1200953
• Mol file: 72590-77-3.mol

Synonyms:hydrocortisone 17-butyrate 21-propionate;hydrocortisone buteprate;Pandel

Chemical Property of Hydrocortisone probutate

Chemical Property:

• Vapor Pressure: 2.28E-17mmHg at 25°C
• Melting Point: 122℃
• Boiling Point: 608.9°C at 760 mmHg
• PKA: 14.13±0.70(Predicted)
• Flash Point: 194.7°C
• PSA: 106.97000
• Density: 1.20
• LogP: 4.09350
• Storage Temp.: -20°C Freezer
• Solubility.: Chloroform (Sparingly), Methanol (Slightly)
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 9
• Exact Mass: 488.27740361
• Heavy Atom Count: 35
• Complexity: 938

Purity/Quality:

99%, ^*data from raw suppliers

Hydrocortisone17-Butyrate21-Propionate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)OC1(CCC2C1(CC(C3C2CCC4=CC(=O)CCC34C)O)C)C(=O)COC(=O)CC
• Isomeric SMILES: CCCC(=O)O[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C)C(=O)COC(=O)CC
• Description: Hydrocortisone butyrate propionate is a potent, topical steroid reported to possess minimal systemic side effects. It is indicated in the treatment of various acute and chronic contact, eczematous, and atopic dermatoses and psoriasis.
• Uses: A synthetic adrenocorticosteroid that acts as an anti-inflammatory and anti-pruritic agents. It is used as a topical for the treatment of dermatologic disorders such as atopic dermatitis and psoriasis.

Technology Process of Hydrocortisone probutate

There total 2 articles about Hydrocortisone probutate 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:

benzene-n-hexane + hydrocortisone 17α-butyrate (13609-67-1) → hydrocortisone butyrate propionate (72590-77-3)

Guidance literature:

In pyridine; ethanol; water;

Reference yield:

→ 11β,17,21-trihydroxypregn-4-ene-3,20-dione 17-butyrate 21-propionate (72590-77-3)

Guidance literature:

aus Hydrocortison-17-butyrat + Propionsaeureanhydrid + Pyridin;

upstream raw materials:

hydrocortisone 17α-butyrate

Refernces