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HR0

Summary
Name:5-hydroxy-2-methylpyrazolo[1,5-a]pyrido[3,2-e]pyrimidine-3-carbonitrile
Formula:C11 H7 N5 O
Formal charge:0
Formula weight:225.206 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.74-methyl-8-oxidanyl-2,3,7,13-tetrazatricyclo[7.4.0.0^{2,6}]trideca-1(9),3,5,7,10,12-hexaene-5-carbonitrile

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C11H7N5O/c1-6-8(5-12)10-14-11(17)7-3-2-4-13-9(7)16(10)15-6/h2-4H,1H3,(H,14,17)
InChIKeyInChI1.03FIRSAIIBSBCBTF-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cc1nn2c3ncccc3c(O)nc2c1C#N
SMILESCACTVS3.385Cc1nn2c3ncccc3c(O)nc2c1C#N
SMILES_CANONICALOpenEye OEToolkits2.0.7Cc1c(c2nc(c3cccnc3n2n1)O)C#N
SMILESOpenEye OEToolkits2.0.7Cc1c(c2nc(c3cccnc3n2n1)O)C#N

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数据于2024-07-17公开中

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