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

Structure Search

SMILES

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

InChI

InChIKey=JKENIRSEIALBGX-PAOVTUTPSA-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 `Sat Dec 16 19:13:32 GMT 2023` Edited by `admin` on `Sat Dec 16 19:13:32 GMT 2023`
Record UNII	VXG27H9MQJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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

Systematic Name

English

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

Systematic Name

English

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

Systematic Name

English

Code System Code Type Description

CAS

135559-18-1

Created by admin on Sat Dec 16 19:13:33 GMT 2023 , Edited by admin on Sat Dec 16 19:13:33 GMT 2023

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PUBCHEM

20845314

Created by admin on Sat Dec 16 19:13:33 GMT 2023 , Edited by admin on Sat Dec 16 19:13:33 GMT 2023

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FDA UNII

VXG27H9MQJ

Created by admin on Sat Dec 16 19:13:33 GMT 2023 , Edited by admin on Sat Dec 16 19:13:33 GMT 2023

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