9-FLUORO-11.BETA.,21-DIHYDROXY-16.ALPHA.-METHYLPREGNA-4-ENE-3,20-DIONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H31FO4
Molecular Weight	378.4775
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 9-FLUORO-11.BETA.,21-DIHYDROXY-16.ALPHA.-METHYLPREGNA-4-ENE-3,20-DIONE

Structure Search

SMILES

[H][C@@]12C[C@@H](C)[C@H](C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]2([H])CCC4=CC(=O)CC[C@]34C

InChI

InChIKey=GROORMIERUNSSM-IIEHVVJPSA-N

InChI=1S/C22H31FO4/c1-12-8-16-15-5-4-13-9-14(25)6-7-21(13,3)22(15,23)18(27)10-20(16,2)19(12)17(26)11-24/h9,12,15-16,18-19,24,27H,4-8,10-11H2,1-3H3/t12-,15+,16+,18+,19-,20+,21+,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H31FO4
Molecular Weight	378.4775
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 `Sat Dec 16 16:48:07 UTC 2023` Edited by `admin` on `Sat Dec 16 16:48:07 UTC 2023`
Record UNII	5B0Z30F0GD
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

9-FLUORO-11.BETA.,21-DIHYDROXY-16.ALPHA.-METHYLPREGNA-4-ENE-3,20-DIONE

Common Name

English

PREGN-4-ENE-3,20-DIONE, 9-FLUORO-11,21-DIHYDROXY-16-METHYL-, (11.BETA.,16.ALPHA.)-

Systematic Name

English

DESOXIMETASONE RELATED COMPOUND A [USP-RS]

Common Name

English

DESOXIMETASONE RELATED COMPOUND A [USP IMPURITY]

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID50628379