1-(2-(4-((1R,2S)-1,2,3,4-TETRAHYDRO-6-HYDROXY-2-PHENYL-1-NAPHTHALENYL)PHENOXY)ETHYL)-2-PYRROLIDINONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H29NO3
Molecular Weight	427.5348
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(2-(4-((1R,2S)-1,2,3,4-TETRAHYDRO-6-HYDROXY-2-PHENYL-1-NAPHTHALENYL)PHENOXY)ETHYL)-2-PYRROLIDINONE

Structure Search

SMILES

OC1=CC=C2[C@H]([C@H](CCC2=C1)C3=CC=CC=C3)C4=CC=C(OCCN5CCCC5=O)C=C4

InChI

InChIKey=YBFAWBLHDMBREC-NAKRPHOHSA-N

InChI=1S/C28H29NO3/c30-23-11-15-26-22(19-23)10-14-25(20-5-2-1-3-6-20)28(26)21-8-12-24(13-9-21)32-18-17-29-16-4-7-27(29)31/h1-3,5-6,8-9,11-13,15,19,25,28,30H,4,7,10,14,16-18H2/t25-,28+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C28H29NO3
Molecular Weight	427.5348
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 07:33:13 GMT 2025` Edited by `admin` on `Wed Apr 02 07:33:13 GMT 2025`
Record UNII	FNT0UY50G8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-(2-(4-((1R,2S)-1,2,3,4-TETRAHYDRO-6-HYDROXY-2-PHENYL-1-NAPHTHALENYL)PHENOXY)ETHYL)-2-PYRROLIDINONE

Systematic Name

English

LASOFOXIFENE METABOLITE M15

Preferred Name

English

2-PYRROLIDINONE, 1-(2-(4-((1R,2S)-1,2,3,4-TETRAHYDRO-6-HYDROXY-2-PHENYL-1-NAPHTHALENYL)PHENOXY)ETHYL)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

10296135

Created by admin on Wed Apr 02 07:33:13 GMT 2025 , Edited by admin on Wed Apr 02 07:33:13 GMT 2025

PRIMARY

FDA UNII

FNT0UY50G8

Created by admin on Wed Apr 02 07:33:13 GMT 2025 , Edited by admin on Wed Apr 02 07:33:13 GMT 2025

PRIMARY

EPA CompTox

DTXSID90437841

Created by admin on Wed Apr 02 07:33:13 GMT 2025 , Edited by admin on Wed Apr 02 07:33:13 GMT 2025

PRIMARY

CAS

366017-88-1

Created by admin on Wed Apr 02 07:33:13 GMT 2025 , Edited by admin on Wed Apr 02 07:33:13 GMT 2025

PRIMARY

Related Record Type Details


					337G83N988

LASOFOXIFENE

PARENT -> METABOLITE

Qualification:

FECAL

Amount: