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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H15F2N3O2
Molecular Weight 295.2846
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-(hydroxymethyl)-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol

SMILES

[H][C@@]1(CO)CO[C@](CN2C=NC=N2)(C1)C3=CC=C(F)C=C3F

InChI

InChIKey=YGEFLWFVJLRJDL-YGRLFVJLSA-N
InChI=1S/C14H15F2N3O2/c15-11-1-2-12(13(16)3-11)14(4-10(5-20)6-21-14)7-19-9-17-8-18-19/h1-3,8-10,20H,4-7H2/t10-,14+/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H15F2N3O2
Molecular Weight 295.2846
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 Sat Dec 16 19:23:04 GMT 2023
Edited
by admin
on Sat Dec 16 19:23:04 GMT 2023
Record UNII
F6PWB58JT6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-(hydroxymethyl)-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol
Systematic Name English
D-threo-Pentitol, 2,5-anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-(hydroxymethyl)-1-(1H-1,2,4-triazol-1-yl)-
Systematic Name English
Code System Code Type Description
FDA UNII
F6PWB58JT6
Created by admin on Sat Dec 16 19:23:04 GMT 2023 , Edited by admin on Sat Dec 16 19:23:04 GMT 2023
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PUBCHEM
10924391
Created by admin on Sat Dec 16 19:23:04 GMT 2023 , Edited by admin on Sat Dec 16 19:23:04 GMT 2023
PRIMARY
EPA CompTox
DTXSID301107737
Created by admin on Sat Dec 16 19:23:04 GMT 2023 , Edited by admin on Sat Dec 16 19:23:04 GMT 2023
PRIMARY
CAS
160709-02-4
Created by admin on Sat Dec 16 19:23:04 GMT 2023 , Edited by admin on Sat Dec 16 19:23:04 GMT 2023
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