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MNY

Summary
Name:5,8-DI-AMINO-1,4-DIHYDROXY-ANTHRAQUINONE
Formula:C14 H10 N2 O4
Formal charge:0
Formula weight:270.24 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.041,4-diamino-5,8-dihydroxyanthracene-9,10-dione
OpenEye OEToolkits1.5.01,4-diamino-5,8-dihydroxy-anthracene-9,10-dione

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C2c1c(c(N)ccc1N)C(=O)c3c2c(O)ccc3O
SMILES_CANONICALCACTVS3.341Nc1ccc(N)c2C(=O)c3c(O)ccc(O)c3C(=O)c12
SMILESCACTVS3.341Nc1ccc(N)c2C(=O)c3c(O)ccc(O)c3C(=O)c12
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc(c2c(c1N)C(=O)c3c(ccc(c3C2=O)O)O)N
SMILESOpenEye OEToolkits1.5.0c1cc(c2c(c1N)C(=O)c3c(ccc(c3C2=O)O)O)N
InChIInChI1.03InChI=1S/C14H10N2O4/c15-5-1-2-6(16)10-9(5)13(19)11-7(17)3-4-8(18)12(11)14(10)20/h1-4,17-18H,15-16H2
InChIKeyInChI1.03QVEMRPAUHFWHRV-UHFFFAOYSA-N

227111

数据于2024-11-06公开中

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