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H35

Summary
Name:N-(FURAN-2-YLMETHYL)-7H-PURIN-6-AMINE
Formula:C10 H9 N5 O
Formal charge:0
Formula weight:215.211 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04N-(furan-2-ylmethyl)-7H-purin-6-amine
OpenEye OEToolkits1.5.0N-(furan-2-ylmethyl)-7H-purin-6-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04n2c(NCc1occc1)c3ncnc3nc2
SMILES_CANONICALCACTVS3.341C(Nc1ncnc2nc[nH]c12)c3occc3
SMILESCACTVS3.341C(Nc1ncnc2nc[nH]c12)c3occc3
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc(oc1)CNc2c3c(nc[nH]3)ncn2
SMILESOpenEye OEToolkits1.5.0c1cc(oc1)CNc2c3c(nc[nH]3)ncn2
InChIInChI1.03InChI=1S/C10H9N5O/c1-2-7(16-3-1)4-11-9-8-10(13-5-12-8)15-6-14-9/h1-3,5-6H,4H2,(H2,11,12,13,14,15)
InChIKeyInChI1.03QANMHLXAZMSUEX-UHFFFAOYSA-N

218196

PDB entries from 2024-04-10

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