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077

Summary
Name:(3S)-5-biphenyl-4-yl-3-hydroxypentanoic acid
Formula:C17 H18 O3
Formal charge:0
Formula weight:270.323 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs10.04(3S)-5-biphenyl-4-yl-3-hydroxypentanoic acid
OpenEye OEToolkits1.6.1(3S)-3-hydroxy-5-(4-phenylphenyl)pentanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)CC(O)CCc1ccc(cc1)c2ccccc2
SMILES_CANONICALCACTVS3.352O[C@@H](CCc1ccc(cc1)c2ccccc2)CC(O)=O
SMILESCACTVS3.352O[CH](CCc1ccc(cc1)c2ccccc2)CC(O)=O
SMILES_CANONICALOpenEye OEToolkits1.6.1c1ccc(cc1)c2ccc(cc2)CC[C@@H](CC(=O)O)O
SMILESOpenEye OEToolkits1.6.1c1ccc(cc1)c2ccc(cc2)CCC(CC(=O)O)O
InChIInChI1.03InChI=1S/C17H18O3/c18-16(12-17(19)20)11-8-13-6-9-15(10-7-13)14-4-2-1-3-5-14/h1-7,9-10,16,18H,8,11-12H2,(H,19,20)/t16-/m0/s1
InChIKeyInChI1.03ILGSIIFHQGOKKV-INIZCTEOSA-N

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건을2024-09-11부터공개중

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