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79X

Summary
Name:2-hydroxy-8,9-dimethoxy-6H-isoindolo[2,1-a]indol-6-one
Formula:C17 H13 N O4
Formal charge:0
Formula weight:295.289 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-hydroxy-8,9-dimethoxy-6H-isoindolo[2,1-a]indol-6-one
OpenEye OEToolkits1.7.02-hydroxy-8,9-dimethoxy-indolo[1,2-b]isoindol-6-one

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C3c4c(c2cc1c(ccc(O)c1)n23)cc(OC)c(OC)c4
SMILES_CANONICALCACTVS3.370COc1cc2C(=O)n3c4ccc(O)cc4cc3c2cc1OC
SMILESCACTVS3.370COc1cc2C(=O)n3c4ccc(O)cc4cc3c2cc1OC
SMILES_CANONICALOpenEye OEToolkits1.7.0COc1cc-2c(cc1OC)C(=O)n3c2cc4c3ccc(c4)O
SMILESOpenEye OEToolkits1.7.0COc1cc-2c(cc1OC)C(=O)n3c2cc4c3ccc(c4)O
InChIInChI1.03InChI=1S/C17H13NO4/c1-21-15-7-11-12(8-16(15)22-2)17(20)18-13-4-3-10(19)5-9(13)6-14(11)18/h3-8,19H,1-2H3
InChIKeyInChI1.03IRPIYZBBHNVOHO-UHFFFAOYSA-N

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數據於2024-07-17公開中

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