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Details

Stereochemistry ACHIRAL
Molecular Formula C13H13ClN6O
Molecular Weight 304.735
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-((2-AMINO-6-CHLORO-9H-PURIN-9-YL)METHYL)-3,5-DIMETHYL-4-PYRIDINOL

SMILES

CC1=C(O)C(C)=C(CN2C=NC3=C(Cl)N=C(N)N=C23)N=C1

InChI

InChIKey=UBBCAAXVXOVGLY-UHFFFAOYSA-N
InChI=1S/C13H13ClN6O/c1-6-3-16-8(7(2)10(6)21)4-20-5-17-9-11(14)18-13(15)19-12(9)20/h3,5H,4H2,1-2H3,(H,16,21)(H2,15,18,19)

HIDE SMILES / InChI

Molecular Formula C13H13ClN6O
Molecular Weight 304.735
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 Thu Jul 06 21:29:12 UTC 2023
Edited
by admin
on Thu Jul 06 21:29:12 UTC 2023
Record UNII
2V5W2R9ZRQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-((2-AMINO-6-CHLORO-9H-PURIN-9-YL)METHYL)-3,5-DIMETHYL-4-PYRIDINOL
Systematic Name English
2-(2-AMINO-6-CHLORO-9H-PURIN-9-YL)METHYL-3,5-DIMETHYLPYRIDIN-4-OL
Systematic Name English
CF2246
Common Name English
2-(2-AMINO-6-CHLOROPURIN-9-YLMETHYL)-3,5-DIMETHYLPYRIDIN-4-OL
Systematic Name English
O-DESMETHYL BIIB021
Common Name English
BIIB021 METABOLITE M2
Common Name English
4-PYRIDINOL, 2-((2-AMINO-6-CHLORO-9H-PURIN-9-YL)METHYL)-3,5-DIMETHYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
16736319
Created by admin on Thu Jul 06 21:29:12 UTC 2023 , Edited by admin on Thu Jul 06 21:29:12 UTC 2023
PRIMARY
CAS
848695-83-0
Created by admin on Thu Jul 06 21:29:12 UTC 2023 , Edited by admin on Thu Jul 06 21:29:12 UTC 2023
PRIMARY
FDA UNII
2V5W2R9ZRQ
Created by admin on Thu Jul 06 21:29:12 UTC 2023 , Edited by admin on Thu Jul 06 21:29:12 UTC 2023
PRIMARY
Related Record Type Details
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