2-HYDROXYMETHYLETHISTERONE

Details

Stereochemistry	UNKNOWN
Molecular Formula	C22H30O3
Molecular Weight	342.4718
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C(CO)C[C@]34C)[C@@H]1CC[C@@]2(O)C#C

InChI

InChIKey=JGJFMZZHCOKXHX-DUGPHZPDSA-N

InChI=1S/C22H30O3/c1-4-22(25)10-8-18-16-6-5-15-11-19(24)14(13-23)12-20(15,2)17(16)7-9-21(18,22)3/h1,11,14,16-18,23,25H,5-10,12-13H2,2-3H3/t14?,16-,17+,18+,20+,21+,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H30O3
Molecular Weight	342.4718
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	6 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
The inhibitory effects of danazol, danazol metabolites, gestrinone, and testosterone on the growth of human endometrial cells in vitro.	1988-02	3338580
[Analysis of danazol and its metabolites in serum by RP-HPLC with maxplot UV detector].	1988	3256205
A comparison of the effects of danazol and gestrinone on testosterone binding to sex hormone binding globulin in vitro and in vivo.	1986-05	3641693
The absorption, distribution and metabolic fate of danazol in rats, monkeys and human volunteers.	1976-06	822792

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:35:19 GMT 2025` Edited by `admin` on `Mon Mar 31 22:35:19 GMT 2025`
Record UNII	57959QO1M0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-HYDROXYMETHYLETHISTERONE

Common Name

English

PREGN-4-EN-20-YN-3-ONE, 17-HYDROXY-2-(HYDROXYMETHYL)-, (17.ALPHA.)-

Preferred Name

English

Code System Code Type Description

PUBCHEM

53953943

Created by admin on Mon Mar 31 22:35:19 GMT 2025 , Edited by admin on Mon Mar 31 22:35:19 GMT 2025

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FDA UNII

57959QO1M0

Created by admin on Mon Mar 31 22:35:19 GMT 2025 , Edited by admin on Mon Mar 31 22:35:19 GMT 2025

PRIMARY

CAS

67110-85-4

Created by admin on Mon Mar 31 22:35:19 GMT 2025 , Edited by admin on Mon Mar 31 22:35:19 GMT 2025

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