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KTP

Summary
Name:(2-NAPHTHALEN-2-YL-1-NAPHTHALEN-1-YL-2-OXO-ETHYL)-PHOSPHONIC ACID
Synonyms:BIS-NAPTHYL BETA-KETOPHOSPHONIC ACID
Formula:C22 H17 O4 P
Formal charge:0
Formula weight:376.342 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04[(1R)-1-naphthalen-1-yl-2-naphthalen-2-yl-2-oxoethyl]phosphonic acid
OpenEye OEToolkits1.5.0[(1R)-1-naphthalen-1-yl-2-naphthalen-2-yl-2-oxo-ethyl]phosphonic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(c2cc1ccccc1cc2)C(c4cccc3ccccc34)P(=O)(O)O
SMILES_CANONICALCACTVS3.341O[P](O)(=O)[C@@H](C(=O)c1ccc2ccccc2c1)c3cccc4ccccc34
SMILESCACTVS3.341O[P](O)(=O)[CH](C(=O)c1ccc2ccccc2c1)c3cccc4ccccc34
SMILES_CANONICALOpenEye OEToolkits1.5.0c1ccc2cc(ccc2c1)C(=O)[C@@H](c3cccc4c3cccc4)P(=O)(O)O
SMILESOpenEye OEToolkits1.5.0c1ccc2cc(ccc2c1)C(=O)C(c3cccc4c3cccc4)P(=O)(O)O
InChIInChI1.03InChI=1S/C22H17O4P/c23-21(18-13-12-15-6-1-2-8-17(15)14-18)22(27(24,25)26)20-11-5-9-16-7-3-4-10-19(16)20/h1-14,22H,(H2,24,25,26)/t22-/m1/s1
InChIKeyInChI1.03OFHMUASCSJJNNA-JOCHJYFZSA-N

223790

건을2024-08-14부터공개중

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