.BETA.-EPOXYABIRATERONE ACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H33NO3
Molecular Weight	407.5451
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .BETA.-EPOXYABIRATERONE ACETATE

Structure Search

SMILES

[H][C@]12C[C@@]3([H])[C@]4([H])CC=C5C[C@H](CC[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@]1(O2)C6=CN=CC=C6)OC(C)=O

InChI

InChIKey=QWQDAOJSWITEOJ-HYSRUFNASA-N

InChI=1S/C26H33NO3/c1-16(28)29-19-8-10-24(2)17(13-19)6-7-20-21(24)9-11-25(3)22(20)14-23-26(25,30-23)18-5-4-12-27-15-18/h4-6,12,15,19-23H,7-11,13-14H2,1-3H3/t19-,20+,21-,22-,23-,24-,25-,26-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H33NO3
Molecular Weight	407.5451
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 `Sat Dec 16 19:07:31 UTC 2023` Edited by `admin` on `Sat Dec 16 19:07:31 UTC 2023`
Record UNII	S332KQE9PM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-EPOXYABIRATERONE ACETATE

Common Name

English

(4S,6AR,6BS,8AS,8BS,9AS,10AS,10BR)-6A,8A-DIMETHYL-8B-(PYRIDIN-3-YL)-3,4,5,6,6A,6B,7,8,8A,8B,9A,10,10A,10B-TETRADECAHYDRO-1H-NAPHTHO(2',1':4,5)INDENO(1,2-B)OXIREN-4-YL ACETATE

Systematic Name

English

.BETA.-EPOXYABIRATERONE ACETATE [USP IMPURITY]

Common Name

English

Code System Code Type Description

PUBCHEM

139210867

Created by admin on Sat Dec 16 19:07:32 UTC 2023 , Edited by admin on Sat Dec 16 19:07:32 UTC 2023

PRIMARY

FDA UNII

S332KQE9PM

Created by admin on Sat Dec 16 19:07:32 UTC 2023 , Edited by admin on Sat Dec 16 19:07:32 UTC 2023

PRIMARY

CAS

2484719-26-6

Created by admin on Sat Dec 16 19:07:32 UTC 2023 , Edited by admin on Sat Dec 16 19:07:32 UTC 2023

PRIMARY

Related Record Type Details


					EM5OCB9YJ6

ABIRATERONE ACETATE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount: