6.ALPHA.-CHLORO-9.ALPHA.-FLUORO-11.BETA.,16.ALPHA.,17,21-TETRAHYDROXYPREGN-4-ENE-3,20-DIONE-21-ACETATE 16,17-ACETONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H34ClFO7
Molecular Weight	512.995
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6.ALPHA.-CHLORO-9.ALPHA.-FLUORO-11.BETA.,16.ALPHA.,17,21-TETRAHYDROXYPREGN-4-ENE-3,20-DIONE-21-ACETATE 16,17-ACETONIDE

Structure Search

SMILES

[H][C@@]12C[C@@]3([H])[C@]4([H])C[C@H](Cl)C5=CC(=O)CC[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]1(OC(C)(C)O2)C(=O)COC(C)=O

InChI

InChIKey=PELLWZQZIYBXGD-IUGZLZTKSA-N

InChI=1S/C26H34ClFO7/c1-13(29)33-12-20(32)26-21(34-22(2,3)35-26)10-15-16-9-18(27)17-8-14(30)6-7-23(17,4)25(16,28)19(31)11-24(15,26)5/h8,15-16,18-19,21,31H,6-7,9-12H2,1-5H3/t15-,16-,18-,19-,21+,23-,24-,25-,26+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H34ClFO7
Molecular Weight	512.995
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 `Fri Dec 15 15:03:05 GMT 2023` Edited by `admin` on `Fri Dec 15 15:03:05 GMT 2023`
Record UNII	WVK8EML8S4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6.ALPHA.-CHLORO-9.ALPHA.-FLUORO-11.BETA.,16.ALPHA.,17,21-TETRAHYDROXYPREGN-4-ENE-3,20-DIONE-21-ACETATE 16,17-ACETONIDE

Systematic Name

English

PREGN-4-ENE-3,20-DIONE, 21-(ACETYLOXY)-6-CHLORO-9-FLUORO-11-HYDROXY-16,17-((1-METHYLETHYLIDENE)BIS(OXY))-, (6.ALPHA.,11.BETA.,16.ALPHA.)-

Systematic Name

English

PREGN-4-ENE-3,20-DIONE, 6.ALPHA.-CHLORO-9-FLUORO-11.BETA.,16.ALPHA.,17,21-TETRAHYDROXY-, CYCLIC 16,17-ACETAL WITH ACETONE, 21-ACETATE

Common Name

English

CORTICOSTERONE, 6.ALPHA.-CHLORO-9-FLUORO-16.ALPHA.,17-DIHYDROXY-, 21-ACETATE, CYCLIC 16,17-ACETAL WITH ACETONE

Common Name

English

Code System Code Type Description

PUBCHEM

155929040

Created by admin on Fri Dec 15 15:03:05 GMT 2023 , Edited by admin on Fri Dec 15 15:03:05 GMT 2023

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CAS

2395-15-5

Created by admin on Fri Dec 15 15:03:05 GMT 2023 , Edited by admin on Fri Dec 15 15:03:05 GMT 2023

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FDA UNII

WVK8EML8S4

Created by admin on Fri Dec 15 15:03:05 GMT 2023 , Edited by admin on Fri Dec 15 15:03:05 GMT 2023

PRIMARY