ENT-VORICONAZOLE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H14F3N5O
Molecular Weight	349.3105
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@H](C1=NC=NC=C1F)[C@@](O)(CN2C=NC=N2)C3=CC=C(F)C=C3F

InChI

InChIKey=BCEHBSKCWLPMDN-HWPZZCPQSA-N

InChI=1S/C16H14F3N5O/c1-10(15-14(19)5-20-7-22-15)16(25,6-24-9-21-8-23-24)12-3-2-11(17)4-13(12)18/h2-5,7-10,25H,6H2,1H3/t10-,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C16H14F3N5O
Molecular Weight	349.3105
Charge	0
Count

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

Description
Sources: http://www.trc-canada.com/product-detail/?V760005

The (2S,3R) enantiomer in Voriconazole (V760000) drug substance

Approval Year

Conditions

Condition	Modality	Targets	Highest Phase	Product
Unknown 2578

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Unknown

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:16:22 UTC 2023` Edited by `admin` on `Sat Dec 16 09:16:22 UTC 2023`
Record UNII	1Y58LNV43M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ENT-VORICONAZOLE

Common Name

English

VORICONAZOLE IMPURITY D [EP IMPURITY]

Common Name

English

VORICONAZOLE ENANTIOMER

Common Name

English

VORICONAZOLE RELATED COMPOUND B [USP IMPURITY]

Common Name

English

4-PYRIMIDINEETHANOL, .ALPHA.-(2,4-DIFLUOROPHENYL)-5-FLUORO-.BETA.-METHYL-.ALPHA.-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-, (.ALPHA.S,.BETA.R)-

Systematic Name

English

VORICONAZOLE RELATED COMPOUND B [USP-RS]

Common Name

English

(2S,3R)-2-(2,4-DIFLUOROPHENYL)-3-(5-FLUOROPYRIMIDIN-4-YL)-1-(1H-1,2,4-TRIAZOL-1-YL)BUTAN-2-OL

Systematic Name

English

VORICONAZOLE RELATED COMPOUND B

Common Name

English

Code System Code Type Description

PUBCHEM

15230631