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T80

Summary
Name:METHYLPENTA(OXYETHYL) HEPTADECANOATE
Formula:C29 H58 O7
Formal charge:0
Formula weight:518.767 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.043,6,9,12,15-pentaoxahexadec-1-yl octadecanoate
OpenEye OEToolkits1.5.02-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl octadecanoate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(OCCOCCOCCOCCOCCOC)CCCCCCCCCCCCCCCCC
SMILES_CANONICALCACTVS3.341CCCCCCCCCCCCCCCCCC(=O)OCCOCCOCCOCCOCCOC
SMILESCACTVS3.341CCCCCCCCCCCCCCCCCC(=O)OCCOCCOCCOCCOCCOC
SMILES_CANONICALOpenEye OEToolkits1.5.0CCCCCCCCCCCCCCCCCC(=O)OCCOCCOCCOCCOCCOC
SMILESOpenEye OEToolkits1.5.0CCCCCCCCCCCCCCCCCC(=O)OCCOCCOCCOCCOCCOC
InChIInChI1.03InChI=1S/C29H58O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-29(30)36-28-27-35-26-25-34-24-23-33-22-21-32-20-19-31-2/h3-28H2,1-2H3
InChIKeyInChI1.03AKUODCGCIHXMIY-UHFFFAOYSA-N

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PDB entries from 2024-07-24

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