BUTIXOCORT PROPIONATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H40O6S
Molecular Weight	504.679
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@](OC(=O)CCC)(C(=O)CSC(=O)CC)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])CCC4=CC(=O)CC[C@]34C

InChI

InChIKey=CDKNUFNIFGPFSF-AYVLZSQQSA-N

InChI=1S/C28H40O6S/c1-5-7-23(32)34-28(22(31)16-35-24(33)6-2)13-11-20-19-9-8-17-14-18(29)10-12-26(17,3)25(19)21(30)15-27(20,28)4/h14,19-21,25,30H,5-13,15-16H2,1-4H3/t19-,20-,21-,25+,26-,27-,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C28H40O6S
Molecular Weight	504.679
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:55:28 GMT 2023` Edited by `admin` on `Fri Dec 15 15:55:28 GMT 2023`
Record UNII	V5R88KKA0L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BUTIXOCORT PROPIONATE

Common Name

English

JO-1222

Code

English

PREGN-4-ENE-3,20-DIONE, 11-HYDROXY-17-(1-OXOBUTOXY)-21-((1-OXOPROPYL)THIO)-, (11.BETA.)-

Systematic Name

English

(11.BETA.)-11-HYDROXY-17-(1-OXOBUTOXY)-21-((1-OXOPROPYL)THIO)PREGN-4-ENE-3,20-DIONE

Systematic Name

English

Code System Code Type Description

FDA UNII

V5R88KKA0L

Created by admin on Fri Dec 15 15:55:28 GMT 2023 , Edited by admin on Fri Dec 15 15:55:28 GMT 2023

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CAS

98449-05-9

Created by admin on Fri Dec 15 15:55:28 GMT 2023 , Edited by admin on Fri Dec 15 15:55:28 GMT 2023

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EPA CompTox

DTXSID80913265

Created by admin on Fri Dec 15 15:55:28 GMT 2023 , Edited by admin on Fri Dec 15 15:55:28 GMT 2023

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PUBCHEM

126937

Created by admin on Fri Dec 15 15:55:28 GMT 2023 , Edited by admin on Fri Dec 15 15:55:28 GMT 2023

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Related Record Type Details


					5D0M4JI29K

BUTIXOCORT

PARENT -> DERIVATIVE