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Y6M

Summary
Name:(2R)-1,2,3,4-tetrahydroquinoline-2,7-diol
Formula:C9 H11 N O2
Formal charge:0
Formula weight:165.189 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(2R)-1,2,3,4-tetrahydroquinoline-2,7-diol
OpenEye OEToolkits1.7.61,2,3,4-tetrahydroquinoline-2,7-diol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Oc1ccc2c(c1)NC(O)CC2
InChIInChI1.03InChI=1S/C9H11NO2/c11-7-3-1-6-2-4-9(12)10-8(6)5-7/h1,3,5,9-12H,2,4H2
InChIKeyInChI1.03PZQZHZIVKKFGLF-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385O[C@@H]1CCc2ccc(O)cc2N1
SMILESCACTVS3.385O[CH]1CCc2ccc(O)cc2N1
SMILES_CANONICALOpenEye OEToolkits1.7.6c1cc2c(cc1O)NC(CC2)O
SMILESOpenEye OEToolkits1.7.6c1cc2c(cc1O)NC(CC2)O

222415

数据于2024-07-10公开中

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