Compound Selection

Formula: C23H30O6

MW: 402.49

CAS: 50-04-4

TNP NUMBER: TNP00595

MDL NUMBER: MFCD03548187

IUPAC: 2-((1S,10S,11S,15S,2R,14R)-14-hydroxy-2,15-dimethyl-5,17-dioxotetracyclo[8.7.0 .0<2,7>.0<11,15>]heptadec-6-en-14-yl)-2-oxoethyl acetate

Smiles: C1([C@@H]2([C]3(C(=CC(CC3)=O)CC[C@H]2([C@H]2([C]([C](C(COC(=O)C)=O)(CC2)O)(C1)C)))C))=O

THERAPEUTIC CATEGORY: Glucocorticoid

ACCEPTORS: 6

DONORS: 1

ROTATION BONDS: 4

N+O: 6

Chiral Centers: 6

LogP: 2.17

LogS: -4.43

LIPINSKI: 4

Synonyms: 11,20-trione,17,21-dihydroxy-pregn-4-ene-21-acetate;11-dehydro-17-hydroxycorticosterone-21-acetate;11-dehydro-17-hydroxycorticosteroneacetate;17,21-dihydroxypregn-4-ene-3,11,20-trioneacetate;20-trione,21-(acetyloxy)-17-hydroxy-pregn-4-ene-11;21-(acetyloxy)-17-hydroxypregn-4-ene-3,11,20-trione;21-acetoxy-17,alpha-hydroxy-3,11,20-triketopregnene-4;21-acetoxy-17,alpha-hydroxypregn-4-ene-3,11,20-trione

CAS:50-04-4

MF:C23H30O6

MW:402.48

EINECS:200-006-5

Product Categories:Biochemistry;Hydroxyketosteroids;Steroids Cortisone acetate

Chemical Properties: mp 237-240 C(lit.) refractive index 212 (C=1, MeOH) Merck 2539 Stability:Stable. Incompatible with strong oxidizing agents.

CAS DataBase Reference: 50-04-4(

CAS DataBase Reference: ) EPA Substance Registry SystemPregn-4-ene-3,11, 20-trione, 21-(acetyloxy)-17-hydroxy- (50-04-4)

Safety Information: Safety Statements 22-36/37 WGK Germany 3 RTECS GM9140000 Cortisone acetate

Usage And Synthesis:

Chemical Properties: solid Cortisone acetate

Chemical Compounds - BioActive Compounds

Structure Search Shop Online Download Databases Request a CD
Structure Search eChemStore Download Request CD

Site Search

Compound Search

share

FacebookTwitterLinkedin

Contact Us

Toll Free 800-574-7391
Phone: 302-292-8500
Fax: 302-292-8520

Chem-TCM is the digital database of molecules from plants used in the traditional Chinese medicine
MyriaScreen II – diversity screening library from Sigma-Aldrich and TimTec
ApexScreen is a collection of 5,040 compounds that were selected to represent the diversity of TimTec stock
Chemistry reagents, HPLC columns, natural compounds
innovative software packages for chemical database management, chemical web server, structure drawing, diversity analysis, clustering, HTS and combinatorial chemistry, prediction of LogP/solubility/Pk, and Spectra Management