21-(ACETYLOXY)-9-FLUORO-1',4'-DIHYDRO-11-HYDROXY-2'H-NAPHTHO(2',3':16,17)PREGN-4-ENE-3,20-DIONE, (11.BETA.,16.BETA.)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H37FO5
Molecular Weight	508.6209
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 21-(ACETYLOXY)-9-FLUORO-1',4'-DIHYDRO-11-HYDROXY-2'H-NAPHTHO(2',3':16,17)PREGN-4-ENE-3,20-DIONE, (11.BETA.,16.BETA.)-

Structure Search

SMILES

[H][C@@]12C[C@@]3([H])[C@]4([H])CCC5=CC(=O)CC[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]1(CC6=C(C2)C=CC=C6)C(=O)COC(C)=O

InChI

InChIKey=NZPNHWNWHUCAOT-RZASPTPKSA-N

InChI=1S/C31H37FO5/c1-18(33)37-17-27(36)30-15-20-7-5-4-6-19(20)12-22(30)14-25-24-9-8-21-13-23(34)10-11-28(21,2)31(24,32)26(35)16-29(25,30)3/h4-7,13,22,24-26,35H,8-12,14-17H2,1-3H3/t22-,24+,25+,26+,28+,29+,30-,31+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C31H37FO5
Molecular Weight	508.6209
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 `Fri Dec 15 15:48:11 GMT 2023` Edited by `admin` on `Fri Dec 15 15:48:11 GMT 2023`
Record UNII	JE162WI19U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

21-(ACETYLOXY)-9-FLUORO-1',4'-DIHYDRO-11-HYDROXY-2'H-NAPHTHO(2',3':16,17)PREGN-4-ENE-3,20-DIONE, (11.BETA.,16.BETA.)-

Common Name

English

2'H-NAPHTHO(2',3':16,17)PREGN-4-ENE-3,20-DIONE, 21-(ACETYLOXY)-9-FLUORO-1',4'-DIHYDRO-11-HYDROXY-, (11.BETA.,16.BETA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

91667693

Created by admin on Fri Dec 15 15:48:11 GMT 2023 , Edited by admin on Fri Dec 15 15:48:11 GMT 2023

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CAS

59497-35-7

Created by admin on Fri Dec 15 15:48:11 GMT 2023 , Edited by admin on Fri Dec 15 15:48:11 GMT 2023

PRIMARY

FDA UNII

JE162WI19U

Created by admin on Fri Dec 15 15:48:11 GMT 2023 , Edited by admin on Fri Dec 15 15:48:11 GMT 2023

PRIMARY