(3Z,20E)-Pregn-4-ene-3,20-dione 3,20-dioxime

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H32N2O2
Molecular Weight	344.491
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of (3Z,20E)-Pregn-4-ene-3,20-dione 3,20-dioxime

Structure Search

SMILES

C\C(=N/O)[C@H]1CC[C@H]2[C@@H]3CCC4=C\C(CC[C@]4(C)[C@H]3CC[C@]12C)=N/O

InChI

InChIKey=JKENIRSEIALBGX-PYFJZWSYSA-N

InChI=1S/C21H32N2O2/c1-13(22-24)17-6-7-18-16-5-4-14-12-15(23-25)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19,24-25H,4-11H2,1-3H3/b22-13+,23-15-/t16-,17+,18-,19-,20-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H32N2O2
Molecular Weight	344.491
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 14:33:43 GMT 2025` Edited by `admin` on `Wed Apr 02 14:33:43 GMT 2025`
Record UNII	6EAY84G65V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Pregn-4-ene-3,20-dione, 3,20-dioxime, (3Z,20E)-

Preferred Name

English

(3Z,20E)-Pregn-4-ene-3,20-dione 3,20-dioxime

Systematic Name

English

Pregn-4-ene-3,20-dione, dioxime, (3Z,20E)-

Systematic Name

English

Code System Code Type Description

CAS

135559-19-2

Created by admin on Wed Apr 02 14:33:43 GMT 2025 , Edited by admin on Wed Apr 02 14:33:43 GMT 2025

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FDA UNII

6EAY84G65V

Created by admin on Wed Apr 02 14:33:43 GMT 2025 , Edited by admin on Wed Apr 02 14:33:43 GMT 2025

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PUBCHEM

12071378

Created by admin on Wed Apr 02 14:33:43 GMT 2025 , Edited by admin on Wed Apr 02 14:33:43 GMT 2025

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