Prednisone Sulfate Sodium

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H25O8S.Na
Molecular Weight	460.473
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[H][C@@]12CC[C@](O)(C(=O)COS([O-])(=O)=O)[C@@]1(C)CC(=O)[C@@]3([H])[C@@]2([H])CCC4=CC(=O)C=C[C@]34C

InChI

InChIKey=ZMVGUXHVPPAVPS-HNGAPHHWSA-M

InChI=1S/C21H26O8S.Na/c1-19-7-5-13(22)9-12(19)3-4-14-15-6-8-21(25,17(24)11-29-30(26,27)28)20(15,2)10-16(23)18(14)19;/h5,7,9,14-15,18,25H,3-4,6,8,10-11H2,1-2H3,(H,26,27,28);/q;+1/p-1/t14-,15-,18+,19-,20-,21-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C21H25O8S
Molecular Weight	437.483
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:12:14 GMT 2023` Edited by `admin` on `Sat Dec 16 20:12:14 GMT 2023`
Record UNII	KX6PW464N9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Prednisone Sulfate Sodium

Common Name

English

Prednisone 21-Sulfate Ester Sodium Salt

Common Name

English

Pregna-1,4-diene-3,11,20-trione, 17,21-dihydroxy-, 21-(hydrogen sulfate), sodium salt

Systematic Name

English

Code System Code Type Description

FDA UNII

KX6PW464N9

Created by admin on Sat Dec 16 20:12:14 GMT 2023 , Edited by admin on Sat Dec 16 20:12:14 GMT 2023

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CAS

113092-08-3

Created by admin on Sat Dec 16 20:12:14 GMT 2023 , Edited by admin on Sat Dec 16 20:12:14 GMT 2023

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