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Details

Stereochemistry RACEMIC
Molecular Formula C7H10FN3O2
Molecular Weight 187.1719
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-FLUOROMETHYLHISTIDINE, (+/-)-

SMILES

C(c1cnc[nH]1)C(CF)(C(=O)O)N

InChI

InChIKey=AJFGLTPLWPTALJ-UHFFFAOYSA-N
InChI=1S/C7H10FN3O2/c8-3-7(9,6(12)13)1-5-2-10-4-11-5/h2,4H,1,3,9H2,(H,10,11)(H,12,13)

HIDE SMILES / InChI

Molecular Formula C7H10FN3O2
Molecular Weight 187.1719
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 16:26:34 UTC 2021
Edited
by admin
on Sat Jun 26 16:26:34 UTC 2021
Record UNII
5PI41O6ETI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-FLUOROMETHYLHISTIDINE, (+/-)-
Systematic Name English
.ALPHA.-FMH, (+/-)-
Common Name English
HISTIDINE, .ALPHA.-(FLUOROMETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
5PI41O6ETI
Created by admin on Sat Jun 26 16:26:34 UTC 2021 , Edited by admin on Sat Jun 26 16:26:34 UTC 2021
PRIMARY
PUBCHEM
107653
Created by admin on Sat Jun 26 16:26:34 UTC 2021 , Edited by admin on Sat Jun 26 16:26:34 UTC 2021
PRIMARY
CAS
70050-43-0
Created by admin on Sat Jun 26 16:26:34 UTC 2021 , Edited by admin on Sat Jun 26 16:26:34 UTC 2021
PRIMARY
Related Record Type Details
ACTIVE ISOMER -> PARENT
INACTIVE ISOMER -> PARENT