U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C11H15FN5O7P
Molecular Weight 379.2383
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-D-2'-DEOXY-2'-.ALPHA.-FLUORO-2'-.BETA.-C-METHYLGUANOSINE-5'-MONOPHOSPHATE

SMILES

C[C@@]1(F)[C@H](O)[C@@H](COP(O)(O)=O)O[C@H]1N2C=NC3=C2N=C(N)NC3=O

InChI

InChIKey=BOEZKCHYGLAVGV-GITKWUPZSA-N
InChI=1S/C11H15FN5O7P/c1-11(12)6(18)4(2-23-25(20,21)22)24-9(11)17-3-14-5-7(17)15-10(13)16-8(5)19/h3-4,6,9,18H,2H2,1H3,(H2,20,21,22)(H3,13,15,16,19)/t4-,6-,9-,11-/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H15FN5O7P
Molecular Weight 379.2383
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 Sat Dec 16 07:27:02 GMT 2023
Edited
by admin
on Sat Dec 16 07:27:02 GMT 2023
Record UNII
C0S1K0S86V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.BETA.-D-2'-DEOXY-2'-.ALPHA.-FLUORO-2'-.BETA.-C-METHYLGUANOSINE-5'-MONOPHOSPHATE
Common Name English
5'-GUANYLIC ACID, 2'-DEOXY-2'-FLUORO-2'-METHYL-, (2'R)-
Systematic Name English
Code System Code Type Description
CAS
1261254-21-0
Created by admin on Sat Dec 16 07:27:02 GMT 2023 , Edited by admin on Sat Dec 16 07:27:02 GMT 2023
PRIMARY
EPA CompTox
DTXSID60155085
Created by admin on Sat Dec 16 07:27:02 GMT 2023 , Edited by admin on Sat Dec 16 07:27:02 GMT 2023
PRIMARY
FDA UNII
C0S1K0S86V
Created by admin on Sat Dec 16 07:27:02 GMT 2023 , Edited by admin on Sat Dec 16 07:27:02 GMT 2023
PRIMARY
PUBCHEM
135564799
Created by admin on Sat Dec 16 07:27:02 GMT 2023 , Edited by admin on Sat Dec 16 07:27:02 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE