4,4-DIFLUOROPREGN-5-ENE-3,20-DIONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H28F2O2
Molecular Weight	350.4426
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4,4-DIFLUOROPREGN-5-ENE-3,20-DIONE

Structure Search

SMILES

[H][C@@]12CC[C@H](C(C)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC=C4C(F)(F)C(=O)CC[C@]34C

InChI

InChIKey=OTTUKNSDVUSPGW-WOEIGVFJSA-N

InChI=1S/C21H28F2O2/c1-12(24)14-5-6-15-13-4-7-17-20(3,11-9-18(25)21(17,22)23)16(13)8-10-19(14,15)2/h7,13-16H,4-6,8-11H2,1-3H3/t13-,14+,15-,16-,19+,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H28F2O2
Molecular Weight	350.4426
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 `Sat Dec 16 05:11:07 GMT 2023` Edited by `admin` on `Sat Dec 16 05:11:07 GMT 2023`
Record UNII	3S6OA3M74Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4,4-DIFLUOROPREGN-5-ENE-3,20-DIONE

Systematic Name

English

NSC-50302

Code

English

PREGN-5-ENE-3,20-DIONE, 4,4-DIFLUORO-

Systematic Name

English

Code System Code Type Description

PUBCHEM

242128