(3,3-bis(4-FPh)2-propenyl)DNJ

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H23F2NO4
Molecular Weight	391.4084
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (3,3-bis(4-FPh)2-propenyl)DNJ

Structure Search

SMILES

OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CC=C(C2=CC=C(F)C=C2)C3=CC=C(F)C=C3

InChI

InChIKey=WXPAVMHHZFXMGH-PLACYPQZSA-N

InChI=1S/C21H23F2NO4/c22-15-5-1-13(2-6-15)17(14-3-7-16(23)8-4-14)9-10-24-11-19(26)21(28)20(27)18(24)12-25/h1-9,18-21,25-28H,10-12H2/t18-,19+,20-,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H23F2NO4
Molecular Weight	391.4084
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:19:34 GMT 2025` Edited by `admin` on `Mon Mar 31 23:19:34 GMT 2025`
Record UNII	746E4Y94T3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2R,3R,4R,5S)-1-[3,3-bis(4-fluorophenyl)prop-2-enyl]-2-(hydroxymethyl)piperidine-3,4,5-triol

Preferred Name

English

(3,3-bis(4-FPh)2-propenyl)DNJ

Common Name

English

3,4,5-Piperidinetriol, 1-[3,3-bis(4-fluorophenyl)-2-propenyl]-2-(hydroxymethyl)-, [2R-(2?,3?,4?,5?)]-

Systematic Name

English

Code System Code Type Description

FDA UNII

746E4Y94T3

Created by admin on Mon Mar 31 23:19:34 GMT 2025 , Edited by admin on Mon Mar 31 23:19:34 GMT 2025

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PUBCHEM

14819944

Created by admin on Mon Mar 31 23:19:34 GMT 2025 , Edited by admin on Mon Mar 31 23:19:34 GMT 2025

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EPA CompTox

DTXSID70926263

Created by admin on Mon Mar 31 23:19:34 GMT 2025 , Edited by admin on Mon Mar 31 23:19:34 GMT 2025

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CAS

128985-10-4

Created by admin on Mon Mar 31 23:19:34 GMT 2025 , Edited by admin on Mon Mar 31 23:19:34 GMT 2025

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