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Details

Stereochemistry ACHIRAL
Molecular Formula C12H19N5O3
Molecular Weight 281.311
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-[2-(dimethylamino)ethyl]-8-(hydroxymethyl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

SMILES

CN(C)CCN1C(CO)=NC2=C1C(=O)N(C)C(=O)N2C

InChI

InChIKey=BJVVUXDBTGLBAP-UHFFFAOYSA-N
InChI=1S/C12H19N5O3/c1-14(2)5-6-17-8(7-18)13-10-9(17)11(19)16(4)12(20)15(10)3/h18H,5-7H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C12H19N5O3
Molecular Weight 281.311
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 Sat Dec 16 12:58:17 GMT 2023
Edited
by admin
on Sat Dec 16 12:58:17 GMT 2023
Record UNII
X7C8RJ9QFC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-[2-(dimethylamino)ethyl]-8-(hydroxymethyl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
Systematic Name English
NSC-36533
Code English
7-[2-(Dimethylamino)ethyl]-3,7-dihydro-8-(hydroxymethyl)-1,3-dimethyl-1H-purine-2,6-dione
Systematic Name English
1H-Purine-2,6-dione, 7-[2-(dimethylamino)ethyl]-3,7-dihydro-8-(hydroxymethyl)-1,3-dimethyl-
Systematic Name English
Code System Code Type Description
FDA UNII
X7C8RJ9QFC
Created by admin on Sat Dec 16 12:58:17 GMT 2023 , Edited by admin on Sat Dec 16 12:58:17 GMT 2023
PRIMARY
PUBCHEM
235298
Created by admin on Sat Dec 16 12:58:17 GMT 2023 , Edited by admin on Sat Dec 16 12:58:17 GMT 2023
PRIMARY
CAS
500338-58-9
Created by admin on Sat Dec 16 12:58:17 GMT 2023 , Edited by admin on Sat Dec 16 12:58:17 GMT 2023
PRIMARY