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AQN

Summary
Name:9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid
Formula:C14 H8 O5 S
Formal charge:0
Formula weight:288.275 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.019,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid
OpenEye OEToolkits1.7.29,10-bis(oxidanylidene)anthracene-2-sulfonic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=S(=O)(O)c3ccc2C(=O)c1c(cccc1)C(=O)c2c3
InChIInChI1.03InChI=1S/C14H8O5S/c15-13-9-3-1-2-4-10(9)14(16)12-7-8(20(17,18)19)5-6-11(12)13/h1-7H,(H,17,18,19)
InChIKeyInChI1.03MMNWSHJJPDXKCH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370O[S](=O)(=O)c1ccc2C(=O)c3ccccc3C(=O)c2c1
SMILESCACTVS3.370O[S](=O)(=O)c1ccc2C(=O)c3ccccc3C(=O)c2c1
SMILES_CANONICALOpenEye OEToolkits1.7.2c1ccc2c(c1)C(=O)c3ccc(cc3C2=O)S(=O)(=O)O
SMILESOpenEye OEToolkits1.7.2c1ccc2c(c1)C(=O)c3ccc(cc3C2=O)S(=O)(=O)O

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PDB entries from 2024-10-09

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