17,21-[(1-Methoxypropylidene)bis(oxy)]pregn-4-ene-3,20-dione

Details

Stereochemistry	EPIMERIC
Molecular Formula	C25H36O5
Molecular Weight	416.5503
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 17,21-[(1-Methoxypropylidene)bis(oxy)]pregn-4-ene-3,20-dione

Structure Search

SMILES

CCC1(OC)OCC(=O)[C@]2(CC[C@H]3[C@@H]4CCC5=CC(=O)CC[C@]5(C)[C@H]4CC[C@]23C)O1

InChI

InChIKey=WACROADFKAOFFA-GPOPSPQYSA-N

InChI=1S/C25H36O5/c1-5-25(28-4)29-15-21(27)24(30-25)13-10-20-18-7-6-16-14-17(26)8-11-22(16,2)19(18)9-12-23(20,24)3/h14,18-20H,5-13,15H2,1-4H3/t18-,19+,20+,22+,23+,24+,25?/m1/s1

HIDE SMILES / InChI

Molecular Formula	C25H36O5
Molecular Weight	416.5503
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	6 / 7
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	KE2FS37BYQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

17,21-[(1-Methoxypropylidene)bis(oxy)]pregn-4-ene-3,20-dione

Systematic Name

English

(4R,8'R,9'S,10'R,13'S,14'S)-2-Ethyl-2-methoxy-10',13'-dimethylspiro[1,3-dioxane-4,17'-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-3',5-dione

Preferred Name

English

Pregn-4-ene-3,20-dione, 17,21-[(1-methoxypropylidene)bis(oxy)]-

Systematic Name

English

Code System Code Type Description

PUBCHEM

155933121

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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FDA UNII

KE2FS37BYQ

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

2905373-61-5

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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