3-OXO-PREGN-4-ENE-20.BETA.-CARBOXALDEHYDE DIOXIME

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H34N2O2
Molecular Weight	358.5176
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of 3-OXO-PREGN-4-ENE-20.BETA.-CARBOXALDEHYDE DIOXIME

Structure Search

SMILES

C[C@@H](\C=N\O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(CC[C@]4(C)[C@H]3CC[C@]12C)=NO

InChI

InChIKey=LPFFRMGUWCHBIL-OVVVNKCHSA-N

InChI=1S/C22H34N2O2/c1-14(13-23-25)18-6-7-19-17-5-4-15-12-16(24-26)8-10-21(15,2)20(17)9-11-22(18,19)3/h12-14,17-20,25-26H,4-11H2,1-3H3/b23-13+,24-16-/t14-,17-,18+,19-,20-,21-,22+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H34N2O2
Molecular Weight	358.5176
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 10:23:12 GMT 2025` Edited by `admin` on `Wed Apr 02 10:23:12 GMT 2025`
Record UNII	75BYI5834N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-OXO-PREGN-4-ENE-20.BETA.-CARBOXALDEHYDE DIOXIME

Common Name

English

NSC-75531

Preferred Name

English

PREGN-4-ENE-20-CARBOXALDEHYDE, 3-(HYDROXYIMINO)-, OXIME, (20R)-

Systematic Name

English

PREGN-4-ENE-20.BETA.-CARBOXALDEHYDE, 3-OXO-, DIOXIME

Common Name

English

U-13053

Code

English

PREGN-4-ENE-20-CARBOXALDEHYDE, 3-OXO-, DIOXIME

Systematic Name

English

Code System Code Type Description

PUBCHEM

156614027