Hydrocortisone cypionate

Base Information

• Chemical Name: Hydrocortisone cypionate
• CAS No.: 508-99-6
• Molecular Formula: C29H42 O6
• Molecular Weight: 486.649
• European Community (EC) Number: 208-091-0
• NSC Number: 10721
• UNII: 4XDY25L70B
• DSSTox Substance ID: DTXSID90872930
• Nikkaji Number: J6.244H
• Wikipedia: Hydrocortisone_cypionate
• Wikidata: Q27106891
• NCI Thesaurus Code: C65864
• Pharos Ligand ID: 44Y1ZUSYV6G4
• Metabolomics Workbench ID: 35407
• ChEMBL ID: CHEMBL1549
• Mol file: 508-99-6.mol

Synonyms:hydrocortisone 21-cyclopentylpropionate;hydrocortisone cypionate

Chemical Property of Hydrocortisone cypionate

Chemical Property:

• Vapor Pressure: 2.34E-19mmHg at 25°C
• Boiling Point: 645°Cat760mmHg
• PKA: 12.33±0.70(Predicted)
• Flash Point: 208.4°C
• PSA: 100.90000
• Density: 1.22g/cm³
• LogP: 4.30290
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 486.29813906
• Heavy Atom Count: 35
• Complexity: 918

Purity/Quality:

98%min ^*data from raw suppliers

Hydrocortisonecypionate 99.97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC12CCC(=O)C=C1CCC3C2C(CC4(C3CCC4(C(=O)COC(=O)CCC5CCCC5)O)C)O
• Isomeric SMILES: C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)COC(=O)CCC5CCCC5)O)C)O
• Uses: Hydrocortisone Cypionate is a metabolite of Hydrocortisone (H714615), a steroid hormone, more specifically a glucocorticoid, produced by the zona fasciculata of the adrenal gland. Cortisol is released in response to stress and a low level of blood glucocorticoids.

Technology Process of Hydrocortisone cypionate

There total 2 articles about Hydrocortisone cypionate 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:

HYDROCORTISONE (50-23-7) + cyclopentanepropanoyl chloride (104-97-2) → hydrocortisone cypionate (508-99-6)

Guidance literature:

With pyridine;

Reference yield:

→ 3-Cyclopentyl-propionic acid 2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxo-ethyl ester (508-99-6,25091-89-8)

Guidance literature:

aus Alkohol II (R=H) mit (c-C5H9CH2CH2C=O)2O;

upstream raw materials:

HYDROCORTISONE

cyclopentanepropanoyl chloride