DEFLUORO-6.BETA.-HYROXYFLUNISOLIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H32O7
Molecular Weight	432.5067
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DEFLUORO-6.BETA.-HYROXYFLUNISOLIDE

Structure Search

SMILES

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

InChI

InChIKey=XDFACIAPTIUOFE-FBUJRGKDSA-N

InChI=1S/C24H32O7/c1-21(2)30-19-9-14-13-8-16(27)15-7-12(26)5-6-22(15,3)20(13)17(28)10-23(14,4)24(19,31-21)18(29)11-25/h5-7,13-14,16-17,19-20,25,27-28H,8-11H2,1-4H3/t13-,14-,16+,17-,19+,20+,22-,23-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H32O7
Molecular Weight	432.5067
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:49:53 GMT 2023` Edited by `admin` on `Sat Dec 16 10:49:53 GMT 2023`
Record UNII	KI122165XG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DEFLUORO-6.BETA.-HYROXYFLUNISOLIDE

Common Name

English

6.BETA.,11.BETA.,16.ALPHA.,17.ALPHA.,21-PENTAHYDROXYPREGNA-1,4-DIENE-3,20-DIONE 16,17-ACETONIDE

Systematic Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 6,11,21-TRIHYDROXY-16,17-((1-METHYLETHYLIDENE)BIS(OXY))-, (6.BETA.,11.BETA.,16.ALPHA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

91810536

Created by admin on Sat Dec 16 10:49:53 GMT 2023 , Edited by admin on Sat Dec 16 10:49:53 GMT 2023

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CAS

73603-90-4

Created by admin on Sat Dec 16 10:49:53 GMT 2023 , Edited by admin on Sat Dec 16 10:49:53 GMT 2023

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FDA UNII

KI122165XG

Created by admin on Sat Dec 16 10:49:53 GMT 2023 , Edited by admin on Sat Dec 16 10:49:53 GMT 2023

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