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9HP

Summary
Name:9-(4-HYDROXYPHENYL)-2,7-PHENANTHROLINE
Formula:C18 H12 N2 O
Formal charge:0
Formula weight:272.301 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.044-(2,7-phenanthrolin-9-yl)phenol
OpenEye OEToolkits1.5.04-(2,7-phenanthrolin-9-yl)phenol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04n2cc(c1ccc(O)cc1)cc4c2ccc3ccncc34
SMILES_CANONICALCACTVS3.341Oc1ccc(cc1)c2cnc3ccc4ccncc4c3c2
SMILESCACTVS3.341Oc1ccc(cc1)c2cnc3ccc4ccncc4c3c2
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc2c(cc(cn2)c3ccc(cc3)O)c4c1ccnc4
SMILESOpenEye OEToolkits1.5.0c1cc2c(cc(cn2)c3ccc(cc3)O)c4c1ccnc4
InChIInChI1.03InChI=1S/C18H12N2O/c21-15-4-1-12(2-5-15)14-9-16-17-11-19-8-7-13(17)3-6-18(16)20-10-14/h1-11,21H
InChIKeyInChI1.03IUSSGTWHFMSCOY-UHFFFAOYSA-N

217705

PDB entries from 2024-03-27

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