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Details

Stereochemistry ACHIRAL
Molecular Formula C17H11BrF2N2O4
Molecular Weight 425.181
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FK-505

SMILES

OC(=O)CN1C(=O)N(CC2=C(F)C=C(Br)C=C2)C(=O)C3=C1C=C(F)C=C3

InChI

InChIKey=XLOHSVVOWVIPFC-UHFFFAOYSA-N
InChI=1S/C17H11BrF2N2O4/c18-10-2-1-9(13(20)5-10)7-22-16(25)12-4-3-11(19)6-14(12)21(17(22)26)8-15(23)24/h1-6H,7-8H2,(H,23,24)

HIDE SMILES / InChI

Molecular Formula C17H11BrF2N2O4
Molecular Weight 425.181
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:37:04 UTC 2023
Edited
by admin
on Fri Dec 15 18:37:04 UTC 2023
Record UNII
KP8T3G9XFE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FK-505
Code English
1(2H)-Quinazolineacetic acid, 3-[(4-bromo-2-fluorophenyl)methyl]-7-fluoro-3,4-dihydro-2,4-dioxo-
Systematic Name English
3-[(4-Bromo-2-fluorophenyl)methyl]-7-fluoro-3,4-dihydro-2,4-dioxo-1(2H)-quinazolineacetic acid
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80150153
Created by admin on Fri Dec 15 18:37:04 UTC 2023 , Edited by admin on Fri Dec 15 18:37:04 UTC 2023
PRIMARY
PUBCHEM
3086955
Created by admin on Fri Dec 15 18:37:04 UTC 2023 , Edited by admin on Fri Dec 15 18:37:04 UTC 2023
PRIMARY
FDA UNII
KP8T3G9XFE
Created by admin on Fri Dec 15 18:37:04 UTC 2023 , Edited by admin on Fri Dec 15 18:37:04 UTC 2023
PRIMARY
CAS
112733-08-1
Created by admin on Fri Dec 15 18:37:04 UTC 2023 , Edited by admin on Fri Dec 15 18:37:04 UTC 2023
PRIMARY