17-Hydroxy-21-(1-oxopropoxy)pregn-4-ene-3,20-dione

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H34O5
Molecular Weight	402.5238
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 17-Hydroxy-21-(1-oxopropoxy)pregn-4-ene-3,20-dione

Structure Search

SMILES

CCC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C

InChI

InChIKey=WREGFCMXQZDLER-PDUMRIMRSA-N

InChI=1S/C24H34O5/c1-4-21(27)29-14-20(26)24(28)12-9-19-17-6-5-15-13-16(25)7-10-22(15,2)18(17)8-11-23(19,24)3/h13,17-19,28H,4-12,14H2,1-3H3/t17-,18+,19+,22+,23+,24+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H34O5
Molecular Weight	402.5238
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 21:05:15 GMT 2025` Edited by `admin` on `Wed Apr 02 21:05:15 GMT 2025`
Record UNII	SUR4ZDY7NL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Clascoterone impurity 3

Preferred Name

English

17-Hydroxy-21-(1-oxopropoxy)pregn-4-ene-3,20-dione

Systematic Name

English

Pregn-4-ene-3,20-dione, 17-hydroxy-21-(1-oxopropoxy)-

Systematic Name

English

2-((8R,9S,10R,13S,14S,17R)-17-Hydroxy-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl propionate

Systematic Name

English

Code System Code Type Description

FDA UNII

SUR4ZDY7NL

Created by admin on Wed Apr 02 21:05:15 GMT 2025 , Edited by admin on Wed Apr 02 21:05:15 GMT 2025

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PUBCHEM

11876423

Created by admin on Wed Apr 02 21:05:15 GMT 2025 , Edited by admin on Wed Apr 02 21:05:15 GMT 2025

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CAS

95624-09-2

Created by admin on Wed Apr 02 21:05:15 GMT 2025 , Edited by admin on Wed Apr 02 21:05:15 GMT 2025

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