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ITY

Summary
Name:icosa-5,8,11,14-tetraynoic acid
Synonyms:5,8,11,14-eicosatetraynoic acid
Formula:C20 H24 O2
Formal charge:0
Formula weight:296.403 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.6icosa-5,8,11,14-tetraynoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C20H24O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-5,8,11,14,17-19H2,1H3,(H,21,22)
InChIKeyInChI1.03MGLDCXPLYOWQRP-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCCCC#CCC#CCC#CCC#CCCCC(O)=O
SMILESCACTVS3.385CCCCCC#CCC#CCC#CCC#CCCCC(O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.6CCCCCC#CCC#CCC#CCC#CCCCC(=O)O
SMILESOpenEye OEToolkits2.0.6CCCCCC#CCC#CCC#CCC#CCCCC(=O)O

225946

PDB entries from 2024-10-09

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