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Details

Stereochemistry ACHIRAL
Molecular Formula C11H14N4O5
Molecular Weight 282.2527
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-HYDROXYETHYL 2-(1,3-DIMETHYL-2,6-DIOXOPURIN-7-YL)ACETATE

SMILES

CN1C2=C(N(CC(=O)OCCO)C=N2)C(=O)N(C)C1=O

InChI

InChIKey=BSHFGYOWIYPMDN-UHFFFAOYSA-N
InChI=1S/C11H14N4O5/c1-13-9-8(10(18)14(2)11(13)19)15(6-12-9)5-7(17)20-4-3-16/h6,16H,3-5H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
2-HYDROXYETHYL 2-(1,3-DIMETHYL-2,6-DIOXOPURIN-7-YL)ACETATE
Common Name English
7H-PURINE-7-ACETIC ACID, 1,2,3,6-TETRAHYDRO-1,3-DIMETHYL-2,6-DIOXO-, 2-HYDROXYETHYL ESTER
Systematic Name English
DOXOPHYLLINE METABOLITE M5
Common Name English
Code System Code Type Description
PUBCHEM
11778508
Created by admin on Sat Dec 16 15:20:16 GMT 2023 , Edited by admin on Sat Dec 16 15:20:16 GMT 2023
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CAS
61379-38-2
Created by admin on Sat Dec 16 15:20:16 GMT 2023 , Edited by admin on Sat Dec 16 15:20:16 GMT 2023
PRIMARY
ECHA (EC/EINECS)
262-741-8
Created by admin on Sat Dec 16 15:20:16 GMT 2023 , Edited by admin on Sat Dec 16 15:20:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID40976912
Created by admin on Sat Dec 16 15:20:16 GMT 2023 , Edited by admin on Sat Dec 16 15:20:16 GMT 2023
PRIMARY
FDA UNII
WLS3PT4QNB
Created by admin on Sat Dec 16 15:20:16 GMT 2023 , Edited by admin on Sat Dec 16 15:20:16 GMT 2023
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