PREGNA-1,4-DIENE-3,20-DIONE, 9,11.BETA.-DICHLORO-6.ALPHA.,21-DIFLUORO-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H24Cl2F2O2
Molecular Weight	417.317
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PREGNA-1,4-DIENE-3,20-DIONE, 9,11.BETA.-DICHLORO-6.ALPHA.,21-DIFLUORO-

Structure Search

SMILES

C[C@]12C[C@H](Cl)[C@@]3(Cl)[C@@H](C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@@H]2C(=O)CF

InChI

InChIKey=NWMSYITVQXEGJD-PAPZHHRGSA-N

InChI=1S/C21H24Cl2F2O2/c1-19-9-18(22)21(23)14(12(19)3-4-13(19)17(27)10-24)8-16(25)15-7-11(26)5-6-20(15,21)2/h5-7,12-14,16,18H,3-4,8-10H2,1-2H3/t12-,13+,14-,16-,18-,19-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H24Cl2F2O2
Molecular Weight	417.317
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 17:36:29 GMT 2025` Edited by `admin` on `Mon Mar 31 17:36:29 GMT 2025`
Record UNII	1P08TXF27C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PREGNA-1,4-DIENE-3,20-DIONE, 9,11.BETA.-DICHLORO-6.ALPHA.,21-DIFLUORO-

Systematic Name

English

9A,11B-DICHLORO-6A,21-DIFLUORO-PREGNA-1,4-DIENE-3,20-DIONE

Preferred Name

English

Code System Code Type Description

PUBCHEM

119025657

Created by admin on Mon Mar 31 17:36:29 GMT 2025 , Edited by admin on Mon Mar 31 17:36:29 GMT 2025

PRIMARY

CAS

858-42-4

Created by admin on Mon Mar 31 17:36:29 GMT 2025 , Edited by admin on Mon Mar 31 17:36:29 GMT 2025

PRIMARY

FDA UNII

1P08TXF27C

Created by admin on Mon Mar 31 17:36:29 GMT 2025 , Edited by admin on Mon Mar 31 17:36:29 GMT 2025

PRIMARY