DES-CICLESONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H38O6
Molecular Weight	470.5977
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@H]3O[C@H](O[C@@]3(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]4([H])[C@@]2([H])CCC5=CC(=O)C=C[C@]45C)C6CCCCC6

InChI

InChIKey=OXPLANUPKBHPMS-ZXBNPROVSA-N

InChI=1S/C28H38O6/c1-26-11-10-18(30)12-17(26)8-9-19-20-13-23-28(22(32)15-29,27(20,2)14-21(31)24(19)26)34-25(33-23)16-6-4-3-5-7-16/h10-12,16,19-21,23-25,29,31H,3-9,13-15H2,1-2H3/t19-,20-,21-,23+,24+,25+,26-,27-,28+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C28H38O6
Molecular Weight	470.5977
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 `Wed Jul 05 23:54:21 UTC 2023` Edited by `admin` on `Wed Jul 05 23:54:21 UTC 2023`
Record UNII	8DL7FH77SF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DES-CICLESONIDE

Common Name

English

CICLESONIDE IMPURITY B [EP IMPURITY]

Common Name

English

(2′R)-2′-cyclohexyl-11β,21-dihydroxy-16βH-[1,3]dioxolo[4′,5′:16,17]pregna-1,4-diene-3,20-dione

Systematic Name

English

(11β,16α)-16,17-[[(R)-Cyclohexylmethylene]bis(oxy)]-11,21-dihydroxypregna-1,4-diene-3,20-dione

Systematic Name

English

DESISOBUTYRYLCICLESONIDE

Common Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 16,17-(((R)-CYCLOHEXYLMETHYLENE)BIS(OXY))-11,21-DIHYDROXY-, (11.BETA.,16.ALPHA.)-

Systematic Name

English

Code System Code Type Description

FDA UNII

8DL7FH77SF

Created by admin on Wed Jul 05 23:54:21 UTC 2023 , Edited by admin on Wed Jul 05 23:54:21 UTC 2023

PRIMARY

CAS

161115-59-9

Created by admin on Wed Jul 05 23:54:21 UTC 2023 , Edited by admin on Wed Jul 05 23:54:21 UTC 2023

PRIMARY

EPA CompTox

DTXSID801043142

Created by admin on Wed Jul 05 23:54:21 UTC 2023 , Edited by admin on Wed Jul 05 23:54:21 UTC 2023

PRIMARY

PUBCHEM

6918281

Created by admin on Wed Jul 05 23:54:21 UTC 2023 , Edited by admin on Wed Jul 05 23:54:21 UTC 2023

PRIMARY

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ACTIVE MOIETY

Amount:

Name	Property Type	Parameters
ORAL BIOAVAILABILITY	PHARMACOKINETIC

Volume of Distribution	PHARMACOKINETIC	INTRAVENOUS ADMINISTRATION