6.ALPHA.-FLUORO-11.BETA.,16.ALPHA.,17,21-TETRAHYDROXYPREGNA-1,4-DIENE-3,20-DIONE CYCLOPENTANONE ACETAL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H33FO6
Molecular Weight	460.535
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6.ALPHA.-FLUORO-11.BETA.,16.ALPHA.,17,21-TETRAHYDROXYPREGNA-1,4-DIENE-3,20-DIONE CYCLOPENTANONE ACETAL

Structure Search

SMILES

[H][C@@]12C[C@H]3OC4(CCCC4)O[C@@]3(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]5([H])[C@@]2([H])C[C@H](F)C6=CC(=O)C=C[C@]56C

InChI

InChIKey=LWKSIQHCQAEEJH-RARYKLRGSA-N

InChI=1S/C26H33FO6/c1-23-8-5-14(29)9-17(23)18(27)10-15-16-11-21-26(20(31)13-28,24(16,2)12-19(30)22(15)23)33-25(32-21)6-3-4-7-25/h5,8-9,15-16,18-19,21-22,28,30H,3-4,6-7,10-13H2,1-2H3/t15-,16-,18-,19-,21+,22+,23-,24-,26+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H33FO6
Molecular Weight	460.535
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 `Fri Dec 15 15:47:20 GMT 2023` Edited by `admin` on `Fri Dec 15 15:47:20 GMT 2023`
Record UNII	363T1C452T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6.ALPHA.-FLUORO-11.BETA.,16.ALPHA.,17,21-TETRAHYDROXYPREGNA-1,4-DIENE-3,20-DIONE CYCLOPENTANONE ACETAL

Common Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 6.ALPHA.-FLUORO-11.BETA.,16.ALPHA.,17,21-TETRAHYDROXY-, CYCLIC 16,17-ACETAL WITH CYCLOPENTANONE

Common Name

English

Code System Code Type Description

FDA UNII

363T1C452T

Created by admin on Fri Dec 15 15:47:20 GMT 2023 , Edited by admin on Fri Dec 15 15:47:20 GMT 2023

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PUBCHEM

91618083

Created by admin on Fri Dec 15 15:47:20 GMT 2023 , Edited by admin on Fri Dec 15 15:47:20 GMT 2023

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CAS

1735-21-3

Created by admin on Fri Dec 15 15:47:20 GMT 2023 , Edited by admin on Fri Dec 15 15:47:20 GMT 2023

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