11.BETA.,16.ALPHA.,17,21-TETRAHYDROXY-2.ALPHA.,9-DIFLUOROPREGN-4-ENE-3,20-DIONE CYCLIC 16,17-ACETONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H32F2O6
Molecular Weight	454.5041
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 11.BETA.,16.ALPHA.,17,21-TETRAHYDROXY-2.ALPHA.,9-DIFLUOROPREGN-4-ENE-3,20-DIONE CYCLIC 16,17-ACETONIDE

Structure Search

SMILES

CC1(C)O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)[C@H](F)C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO

InChI

InChIKey=YNALNBBXJYULHD-XQJFNSGMSA-N

InChI=1S/C24H32F2O6/c1-20(2)31-19-8-14-13-6-5-12-7-16(28)15(25)9-21(12,3)23(13,26)17(29)10-22(14,4)24(19,32-20)18(30)11-27/h7,13-15,17,19,27,29H,5-6,8-11H2,1-4H3/t13-,14-,15+,17-,19+,21-,22-,23-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H32F2O6
Molecular Weight	454.5041
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 17:54:24 GMT 2025` Edited by `admin` on `Mon Mar 31 17:54:24 GMT 2025`
Record UNII	YTJ3MK323R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PREGN-4-ENE-3,20-DIONE, 2.ALPHA.,9-DIFLUORO-11 .BETA.,16.ALPHA.,17,21-TETRAHYDROXY-, CYCLIC 16,17-ACETAL WITH ACETONE

Preferred Name

English

11.BETA.,16.ALPHA.,17,21-TETRAHYDROXY-2.ALPHA.,9-DIFLUOROPREGN-4-ENE-3,20-DIONE CYCLIC 16,17-ACETONIDE

Systematic Name

English

PREGN-4-ENE-3,20-DIONE, 2.ALPHA.,9-DIFLUORO-11.BETA.,16.ALPHA.,17,21-TETRAHYDROXY-, CYCLIC 16,17-ACETAL WITH ACETONE

Systematic Name

English

Code System Code Type Description

PUBCHEM

155928965

Created by admin on Mon Mar 31 17:54:24 GMT 2025 , Edited by admin on Mon Mar 31 17:54:24 GMT 2025

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FDA UNII

YTJ3MK323R

Created by admin on Mon Mar 31 17:54:24 GMT 2025 , Edited by admin on Mon Mar 31 17:54:24 GMT 2025

PRIMARY

CAS

2261-22-5

Created by admin on Mon Mar 31 17:54:24 GMT 2025 , Edited by admin on Mon Mar 31 17:54:24 GMT 2025

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