CAS 145-15-3 | Pregn-4-en-3-one, 20-hydroxy-, (20R)- | CAS Number 145-15-3

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Other Building Blocks > 145-15-3

145-15-3 | Pregn-4-en-3-one, 20-hydroxy-, (20R)-

CAS No: 145-15-3 Catalog No: AG001KFQ MDL No:MFCD00067664

Product Description

Catalog Number:

AG001KFQ

Chemical Name:

Pregn-4-en-3-one, 20-hydroxy-, (20R)-

CAS Number:

145-15-3

Molecular Formula:

C21H32O2

Molecular Weight:

316.4776

MDL Number:

MFCD00067664

IUPAC Name:

(8S,9S,10R,13S,14S,17S)-17-[(1R)-1-hydroxyethyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

InChI:

InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12-13,16-19,22H,4-11H2,1-3H3/t13-,16+,17-,18+,19+,20+,21-/m1/s1

InChI Key:

RWBRUCCWZPSBFC-SJOKZOANSA-N

SMILES:

O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2[C@H](O)C)C)C

EC Number:

205-650-0

Properties

Complexity:

550

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

316.24g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

316.485g/mol

Monoisotopic Mass:

316.24g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.2

Literature

Title	Journal
Studies on neurosteroids XXII. Liquid chromatography-tandem mass spectrometric method for profiling rat brain 3-oxo-4-ene-neuroactive steroids.	Biomedical chromatography : BMC 20080101
Corticosterone metabolism in chicken tissues: evidence for tissue-specific distribution of steroid dehydrogenases.	General and comparative endocrinology 20060701
[Effect of steroid biosynthesis modificators on the progesterone biotransformation by a recombinant yeasts expressing cytochrome P450c17].	Biomeditsinskaia khimiia 20060101
Glucocorticoid metabolism and Na+ transport in chicken intestine.	Journal of experimental zoology. Part A, Comparative experimental biology 20050201