Home Other Building Blocks 5A-PREGNAN-21-OL-3-20-DIONE CRYSTALLINE

5A-PREGNAN-21-OL-3-20-DIONE CRYSTALLINE

CAS No.:
298-36-2
Catalog Number:
AG00C2UT
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C2UT
Chemical Name:
5A-PREGNAN-21-OL-3-20-DIONE CRYSTALLINE
CAS Number:
298-36-2
MDL Number:
MFCD00056498
IUPAC Name:
(5S,8R,9S,10S,13S,14S,17S)-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
InChI:
InChI=1S/C21H32O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h13,15-18,22H,3-12H2,1-2H3/t13-,15-,16-,17-,18+,20-,21-/m0/s1
InChI Key:
USPYDUPOCUYHQL-KVHKMPIWSA-N
Properties
Complexity:
555  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
7  
Defined Bond Stereocenter Count:
0
Exact Mass:
332.235g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
332.484g/mol
Monoisotopic Mass:
332.235g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Literature
Title Journal
5alphaDH-DOC (5alpha-dihydro-deoxycorticosterone) activates androgen receptor in castration-resistant prostate cancer. Cancer science 20100801
Editorial comment. The Journal of urology 20090901
Increased reverse triiodothyronine is associated with shorter survival in independently-living elderly: the Alsanut study. European journal of endocrinology 20090201
Predicting end-stage renal disease: Bayesian perspective of information transfer in the clinical decision-making process at the individual level. Kidney international 20030501
Viadril: a new steroid anaesthetic; preliminary communication. British medical journal 19560721
Properties