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E6T

Summary
Name:3-(3-hydroxyphenyl)-1~{H}-pyrrolo[3,4-g]indol-8-one
Formula:C16 H10 N2 O2
Formal charge:0
Formula weight:262.263 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.63-(3-hydroxyphenyl)-1~{H}-pyrrolo[3,4-g]indol-8-one

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C16H10N2O2/c19-11-3-1-2-9(6-11)13-8-17-15-12(13)5-4-10-7-18-16(20)14(10)15/h1-8,17,19H
InChIKeyInChI1.03NIESWLNGCVKLAW-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1cccc(c1)c2c[nH]c3c2ccc4C=NC(=O)c34
SMILESCACTVS3.385Oc1cccc(c1)c2c[nH]c3c2ccc4C=NC(=O)c34
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cc(cc(c1)O)c2c[nH]c3c2ccc4c3C(=O)N=C4
SMILESOpenEye OEToolkits2.0.6c1cc(cc(c1)O)c2c[nH]c3c2ccc4c3C(=O)N=C4

219140

PDB entries from 2024-05-01

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