3,20-PREGNANEDIONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H32O2
Molecular Weight	316.4776
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C

InChI

InChIKey=XMRPGKVKISIQBV-XWOJZHJZSA-N

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/h14,16-19H,4-12H2,1-3H3/t14-,16+,17-,18+,19+,20+,21-/m1/s1

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

Show entries

Title	Date	PubMed
The nuclear pregnane X receptor: a key regulator of xenobiotic metabolism.	2002 Oct	12372848
A PXR reporter gene assay in a stable cell culture system: CYP3A4 and CYP2B6 induction by pesticides.	2004 Dec 15	15548381
Crystallization and preliminary crystallographic analysis of selenomethionine-labelled progesterone 5beta-reductase from Digitalis lanata Ehrh.	2006 Mar 1	16511297
In silico prediction of pregnane X receptor activators by machine learning approaches.	2007 Jan	17003167
The crystal structure of progesterone 5beta-reductase from Digitalis lanata defines a novel class of short chain dehydrogenases/reductases.	2008 Jun 20	18032383

Showing 1 to 5 of 5 entries

Previous1Next

Show entries

Name

Type

Language

NSC-82868

Preferred Name

English

3,20-PREGNANEDIONE

Systematic Name

English

3,20-PREGNANEDIONE [MI]

Common Name

English

PREGNANE-3,20-DIONE, (5.BETA.)-

Systematic Name

English

U-2411

Code

English

Showing 1 to 5 of 7 entries

Previous1 2Next

Show entries

Code System

Code

Type

Description

CHEBI

30154

PRIMARY

WIKIPEDIA

5?-Dihydroprogesterone

PRIMARY

MERCK INDEX

m9116

PRIMARY

Merck Index

CAS

128-23-4

PRIMARY

DRUG BANK

DB07557

PRIMARY

Showing 1 to 5 of 9 entries

Previous1 2Next

SUBSTANCE RECORD


					105J2Q45A0

3,20-PREGNANEDIONE