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U9V

Summary
Name:pentadecyl(tetradecyl)peroxyanhydride
Formula:C33 H64 O4
Formal charge:0
Formula weight:524.859 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-(pentadecanoyloxy)ethyl hexadecanoate
OpenEye OEToolkits2.0.72-pentadecanoyloxyethyl hexadecanoate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O(C(=O)CCCCCCCCCCCCCCC)CCOC(=O)CCCCCCCCCCCCCC
InChIInChI1.03InChI=1S/C33H64O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(35)37-31-30-36-32(34)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-31H2,1-2H3
InChIKeyInChI1.03VKLOIKIKCDJYHU-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCCC
SMILESCACTVS3.385CCCCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCCC
SMILES_CANONICALOpenEye OEToolkits2.0.7CCCCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCCC
SMILESOpenEye OEToolkits2.0.7CCCCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCCC

222415

PDB entries from 2024-07-10

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