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E2V

Summary
Name:(2R)-2-(hexadecanoyloxy)propyl nonadecanoate
Formula:C38 H74 O4
Formal charge:0
Formula weight:594.992 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(2R)-2-(hexadecanoyloxy)propyl nonadecanoate
OpenEye OEToolkits2.0.6[(2~{R})-2-hexadecanoyloxypropyl] nonadecanoate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C(CCCCCCCCC(=O)OCC(OC(CCCCCCCCCCCCCCC)=O)C)CCCCCCCCC
InChIInChI1.03InChI=1S/C38H74O4/c1-4-6-8-10-12-14-16-18-19-20-22-23-25-27-29-31-33-37(39)41-35-36(3)42-38(40)34-32-30-28-26-24-21-17-15-13-11-9-7-5-2/h36H,4-35H2,1-3H3/t36-/m1/s1
InChIKeyInChI1.03AZEJVFRTMDKJQJ-PSXMRANNSA-N
SMILES_CANONICALCACTVS3.385CCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](C)OC(=O)CCCCCCCCCCCCCCC
SMILESCACTVS3.385CCCCCCCCCCCCCCCCCCC(=O)OC[CH](C)OC(=O)CCCCCCCCCCCCCCC
SMILES_CANONICALOpenEye OEToolkits2.0.6CCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](C)OC(=O)CCCCCCCCCCCCCCC
SMILESOpenEye OEToolkits2.0.6CCCCCCCCCCCCCCCCCCC(=O)OCC(C)OC(=O)CCCCCCCCCCCCCCC

222624

數據於2024-07-17公開中

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