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A7F

Summary
Name:Arcyriaflavin A
Synonyms:12,13-dihydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione
Formula:C20 H11 N3 O2
Formal charge:0
Formula weight:325.32 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.0112,13-dihydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C1NC(=O)c2c3c4ccccc4[NH]c3c3[NH]c4ccccc4c3c21
InChIInChI1.06InChI=1S/C20H11N3O2/c24-19-15-13-9-5-1-3-7-11(9)21-17(13)18-14(16(15)20(25)23-19)10-6-2-4-8-12(10)22-18/h1-8,21-22H,(H,23,24,25)
InChIKeyInChI1.06KAJXOWFGKYKMMZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385O=C1NC(=O)c2c1c3c([nH]c4ccccc34)c5[nH]c6ccccc6c25
SMILESCACTVS3.385O=C1NC(=O)c2c1c3c([nH]c4ccccc34)c5[nH]c6ccccc6c25
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc2c(c1)c3c4c(c5c6ccccc6[nH]c5c3[nH]2)C(=O)NC4=O
SMILESOpenEye OEToolkits2.0.7c1ccc2c(c1)c3c4c(c5c6ccccc6[nH]c5c3[nH]2)C(=O)NC4=O

225946

数据于2024-10-09公开中

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