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

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H34ClFO5
Molecular Weight	468.986
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

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

InChI

InChIKey=JURRNLVFTVGKIQ-GGMMKCCRSA-N

InChI=1S/C25H34ClFO5/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/h14-15,17-18H,5-13H2,1-4H3/t14-,15+,17-,18-,22-,23-,24-,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H34ClFO5
Molecular Weight	468.986
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 `Fri Dec 15 15:25:37 GMT 2023` Edited by `admin` on `Fri Dec 15 15:25:37 GMT 2023`
Record UNII	61Y145N74D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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

Systematic Name

English

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

Systematic Name

English

Code System Code Type Description

PUBCHEM

12848869

Created by admin on Fri Dec 15 15:25:37 GMT 2023 , Edited by admin on Fri Dec 15 15:25:37 GMT 2023

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CAS

80163-80-0

Created by admin on Fri Dec 15 15:25:37 GMT 2023 , Edited by admin on Fri Dec 15 15:25:37 GMT 2023

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FDA UNII

61Y145N74D

Created by admin on Fri Dec 15 15:25:37 GMT 2023 , Edited by admin on Fri Dec 15 15:25:37 GMT 2023

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