21-CHLORO-9-FLUORO-11-HYDROXY-16-METHYL-17-(1-OXOPROPOXY)-PREGNANE-3,20-DIONE, (5.BETA.,11.BETA.,16.BETA.)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H36ClFO5
Molecular Weight	471.002
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 21-CHLORO-9-FLUORO-11-HYDROXY-16-METHYL-17-(1-OXOPROPOXY)-PREGNANE-3,20-DIONE, (5.BETA.,11.BETA.,16.BETA.)-

Structure Search

SMILES

[H][C@@]12C[C@H](C)[C@](OC(=O)CC)(C(=O)CCl)[C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]2([H])CC[C@]4([H])CC(=O)CC[C@]34C

InChI

InChIKey=AJWNGOKNEBVXJK-LNLHLLADSA-N

InChI=1S/C25H36ClFO5/c1-5-21(31)32-25(20(30)13-26)14(2)10-18-17-7-6-15-11-16(28)8-9-22(15,3)24(17,27)19(29)12-23(18,25)4/h14-15,17-19,29H,5-13H2,1-4H3/t14-,15+,17-,18-,19-,22-,23-,24-,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H36ClFO5
Molecular Weight	471.002
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 15:36:55 GMT 2023` Edited by `admin` on `Fri Dec 15 15:36:55 GMT 2023`
Record UNII	BIQ5QQF56U
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

21-CHLORO-9-FLUORO-11-HYDROXY-16-METHYL-17-(1-OXOPROPOXY)-PREGNANE-3,20-DIONE, (5.BETA.,11.BETA.,16.BETA.)-

Systematic Name

English

PREGNANE-3,20-DIONE, 21-CHLORO-9-FLUORO-11-HYDROXY-16-METHYL-17-(1-OXOPROPOXY)-, (5.BETA.,11.BETA.,16.BETA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

12848841

Created by admin on Fri Dec 15 15:36:55 GMT 2023 , Edited by admin on Fri Dec 15 15:36:55 GMT 2023

PRIMARY

CAS

80042-35-9

Created by admin on Fri Dec 15 15:36:55 GMT 2023 , Edited by admin on Fri Dec 15 15:36:55 GMT 2023

PRIMARY

FDA UNII

BIQ5QQF56U

Created by admin on Fri Dec 15 15:36:55 GMT 2023 , Edited by admin on Fri Dec 15 15:36:55 GMT 2023

PRIMARY