ABIRATERONE ETHYL ETHER

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H35NO
Molecular Weight	377.5622
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC=C(C3=CC=CN=C3)[C@@]1(C)CC[C@@]4([H])[C@@]2([H])CC=C5C[C@H](CC[C@]45C)OCC

InChI

InChIKey=VGZRPOHXSOUGFK-UBUQANBQSA-N

InChI=1S/C26H35NO/c1-4-28-20-11-13-25(2)19(16-20)7-8-21-23-10-9-22(18-6-5-15-27-17-18)26(23,3)14-12-24(21)25/h5-7,9,15,17,20-21,23-24H,4,8,10-14,16H2,1-3H3/t20-,21-,23-,24-,25-,26+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H35NO
Molecular Weight	377.5622
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:05:57 UTC 2023` Edited by `admin` on `Sat Dec 16 11:05:57 UTC 2023`
Record UNII	584RL9VDX7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ABIRATERONE ETHYL ETHER

Common Name

English

3.BETA.-ETHOXY-17-(PYRIDIN-3-YL)ANDROSTA-5,16-DIENE

Systematic Name

English

ABIRATERONE ETHYL ETHER [USP IMPURITY]

Common Name

English

3-((8R,9R,10R,13S,14R)-3-ETHOXY-10,13-DIMETHYL-2,3,4,7,8,9,11,12,14,15-DECAHYDRO-1H-CYCLOPENTA(A)PHENANTHREN-17-YL)PYRIDINE

Systematic Name

English

Code System Code Type Description

PUBCHEM

145709107

Created by admin on Sat Dec 16 11:05:58 UTC 2023 , Edited by admin on Sat Dec 16 11:05:58 UTC 2023

PRIMARY

CAS

2484719-14-2

Created by admin on Sat Dec 16 11:05:58 UTC 2023 , Edited by admin on Sat Dec 16 11:05:58 UTC 2023

PRIMARY

FDA UNII

584RL9VDX7

Created by admin on Sat Dec 16 11:05:58 UTC 2023 , Edited by admin on Sat Dec 16 11:05:58 UTC 2023

PRIMARY

Related Record Type Details


					EM5OCB9YJ6

ABIRATERONE ACETATE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount: