CNS

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Summary

Name:HEXADECYL OCTANOATE
Formula:C24 H48 O2
Formal charge:0
Molecular weight:368.637 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04hexadecyl octanoate
OpenEye OEToolkits1.5.0hexadecyl octanoate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(OCCCCCCCCCCCCCCCC)CCCCCCC
SMILES_CANONICALCACTVS3.341CCCCCCCCCCCCCCCCOC(=O)CCCCCCC
SMILESCACTVS3.341CCCCCCCCCCCCCCCCOC(=O)CCCCCCC
SMILES_CANONICALOpenEye OEToolkits1.5.0CCCCCCCCCCCCCCCCOC(=O)CCCCCCC
SMILESOpenEye OEToolkits1.5.0CCCCCCCCCCCCCCCCOC(=O)CCCCCCC
InChIInChI1.03InChI=1S/C24H48O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-19-21-23-26-24(25)22-20-18-8-6-4-2/h3-23H2,1-2H3
InChIKeyInChI1.03DWMMZQMXUWUJME-UHFFFAOYSA-N
167518
PDB entries from 2020-08-12